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(2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4-amino-3-[[(2S,3R)-3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-6-(ethylamino)-2-hydroxy-cyclohexoxy]-5-methyl-4-(methylamino)tetrahydropyran-3,5-diol; sulfuric acid
(2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4-amino-3-[[(2S,3R)-3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-6-(ethylamino)-2-hydroxy-cyclohexoxy]-5-methyl-4-(methylamino)tetrahydropyran-3,5-diol; sulfuric acid ID: AN-40140
CAS:56391-57-2
Supplier:AN PharmaTech Co Ltd

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SMILES:S(=O)(=O)(O)O.S(=O)(=O)(O)O.S(=O)(=O)(O)O.S(=O)(=O)(O)O.S(=O)(=O)(O)O.O([C@H]1[C@H](NCC)C[C@H](N)[C@@H](O[C@H]2OC(=CC[C@H]2N)CN)[C@@H]1O)[C@H]1OC[C@](O)([C@H](NC)[C@H]1O)C.O([C@H]1[C@H](NCC)C[C@H](N)[C@@H](O[C@H]2OC(=CC[C@H]2N)CN)[C@@H]1O)[C@H]1OC[C@](O)([C@H](NC)[C@H]1O)C	62115
FORMULA: C42H92N10O34S5
MASS: 1441.5515
EXACT MASS: 1440.4380951
INTERATOMIC DISTANCES

              S   1      S   2      S   3      S   4      S   5      O   6
              ------------------------------------------------------------------
   S   1    0.0000 
   S   2    3.7321     0.0000 
   S   3   11.6278     9.1277     0.0000 
   S   4    7.4641     3.7320     7.6995     0.0000 
   S   5   14.6613    11.6278     3.7321     9.1278     0.0000 
   O   6   16.4192    13.7650    18.4986    11.7141    18.1082     0.0000 
   O   7   18.1980    14.4662    12.1700    10.7345     9.5932    11.7697 
   O   8   15.2767    11.5703     8.7732     7.8882     6.5789    12.3613 
   O   9   13.0200    10.5736    16.3946     9.0519    16.6398     3.4641 
   O  10   17.2675    13.5548    10.3192     9.8568     7.6073    12.9304 
   O  11   14.5574    11.8012    16.6105     9.7199    16.4036     2.0000 
   O  12   18.2637    14.5486    11.1465    10.8454     8.2562    13.3188 
   O  13   15.3661    12.4901    16.8068    10.1856    16.3761     1.7321 
   O  14   20.1980    16.4660    13.7705    12.7343    10.8912    12.8420 
   O  15   17.9996    15.1309    19.0085    12.7185    18.2237     2.0000 
   O  16   19.9923    16.3278    11.6463    12.7029     8.2681    15.6531 
   O  17   15.7104    12.4702    15.4412     9.5945    14.5924     3.8982 
   O  18   13.5549     9.8568     7.6074     6.1997     6.0920    12.1162 
   O  19   11.8013     9.7199    16.4036     8.8057    17.0324     5.0390 
   O  20    1.0000     3.3461    11.8539     7.0177    14.7150    15.4840 
   O  21   14.6757    11.4846     4.3198     8.7335     1.0000    17.2480 
   O  22   14.7151    11.8540     3.3461     9.6104     1.0001    18.9821 
   O  23    8.0110     4.3197     8.4886     1.0000     9.6103    10.7168 
   O  24    7.0178     3.3460     6.9647     1.0001     8.7334    12.7119 
   O  25   11.4846     8.7335     1.0000     6.9648     3.3461    17.5515 
   O  26   11.8540     9.6103     1.0001     8.4887     4.3198    19.4512 
   O  27    4.3198     1.0000     9.6103     3.3460    11.8539    12.7817 
   O  28    3.3461     1.0001     8.7334     4.3197    11.4845    14.7506 
   O  29    1.0001     4.3198    11.4845     8.0111    14.6757    17.3616 
   O  30    1.0000     2.9094    10.6468     6.6170    13.6615    16.1027 
   O  31    1.0000     4.6252    12.6118     8.3451    15.6611    16.7893 
   O  32    4.6252     1.0000     8.2418     2.9093    10.6468    13.6252 
   O  33    2.9093     1.0001    10.0352     4.6252    12.6119    13.9752 
   O  34   12.6119    10.0352     1.0001     8.3789     2.9093    18.8350 
   O  35   10.6468     8.2418     1.0000     7.0963     4.6252    18.2110 
   O  36    8.3452     4.6252     7.0963     1.0001     8.2418    11.8260 
   O  37    6.6170     2.9093     8.3789     1.0000    10.0352    11.6870 
   O  38   15.6611    12.6118     4.6252    10.0352     1.0000    18.6260 
   O  39   13.6615    10.6468     2.9094     8.2418     1.0000    17.6319 
   N  40   16.8778    14.5675    20.0341    12.9391    19.8629     2.0000 
   N  41   17.3027    13.5995    12.6576     9.9183    10.5640     9.7707 
   N  42   14.3471    10.6206     9.9268     6.9003     8.4451    10.0041 
   N  43   14.0677    12.1095    18.6083    11.1014    18.9955     3.8981 
   N  44   17.9084    14.7717    17.7245    11.9815    16.6574     3.4641 
   N  45   21.2543    17.5343    13.7666    13.8210    10.5379    14.8317 
   N  46   11.7617     8.9786    14.3972     7.1240    14.6757     4.7883 
   N  47   15.6079    12.0042     7.5418     8.5119     4.8157    14.3228 
   N  48    9.8282     8.4377    16.2678     8.5820    17.4660     7.6624 
   N  49   11.0600     7.4255     5.8908     3.9762     5.7736    12.7038 
   C  50   15.6649    13.1431    18.3204    11.3115    18.1331     1.0000 
   C  51   17.1981    13.4662    11.4171     9.7347     9.0408    11.3282 
   C  52   16.7297    13.0069    11.6792     9.2917     9.5666    10.3344 
   C  53   15.9068    13.5687    19.1107    11.9604    19.0295     1.7320 
   C  54   14.7158    12.1506    17.3922    10.3236    17.3029     1.7321 
   C  55   16.7115    12.9835    10.4661     9.2589     8.0409    11.9441 
   C  56   13.9770    11.5716    17.2895    10.0153    17.4153     2.6458 
   C  57   15.7124    11.9850     9.7356     8.2620     7.5738    11.6390 
   C  58   15.1982    11.4664    10.0416     7.7351     8.1943    10.6741 
   C  59   14.2476    12.0529    18.1249    10.7429    18.3470     3.0000 
   C  60   15.7317    12.0103    11.0293     8.2987     9.1775     9.9801 
   C  61   15.2259    13.0528    19.0173    11.6953    19.1318     2.6457 
   C  62   18.7099    14.9810    12.0440    11.2543     9.2328    12.7693 
   C  63   16.2773    13.4575    17.7655    11.1856    17.2507     1.0001 
   C  64   19.7093    15.9800    12.8769    12.2526     9.9267    13.2760 
   C  65   17.0924    14.1718    18.0327    11.7212    17.3114     1.7321 
   C  66   20.2571    16.5385    12.8748    12.8279     9.7341    14.2753 
   C  67   17.0444    13.9811    17.3665    11.3264    16.5037     2.6458 
   C  68   16.1764    13.0525    16.3844    10.3400    15.5872     3.0000 
   C  69   19.8456    16.1479    12.0395    12.4707     8.8133    14.7688 
   C  70   15.3127    12.2733    16.0900     9.7286    15.5197     2.6458 
   C  71   18.8535    15.1599    11.1442    11.4914     8.0237    14.3150 
   C  72   12.0458     9.6873    15.8763     8.3931    16.3285     4.4641 
   C  73   14.4779    10.7967     7.8037     7.1683     5.8031    12.7037 
   C  74   17.1900    15.0526    20.8314    13.6206    20.7569     2.9999 
   C  75   16.9260    13.2584    13.0102     9.6407    11.1527     8.7713 
   C  76   11.3801     8.8458    14.8762     7.4060    15.3579     5.0391 
   C  77   14.6535    11.0310     7.1311     7.5166     4.8610    13.6952 
   C  78   20.7699    17.0830    12.6347    13.4212     9.2680    15.6321 
   C  79   16.7084    13.4683    16.2200    10.5584    15.2031     3.8983 
   C  80   10.3963     7.9555    14.4074     6.8084    15.1196     6.0267 
   C  81   13.9269    10.3624     6.1465     6.9757     4.1257    14.1117 
   C  82   17.5781    13.9483    14.0028    10.3913    12.1435     8.2826 
   C  83   18.1751    16.0526    21.7507    14.5909    21.5932     3.6055 
   C  84   21.7082    17.9784    14.6059    14.2498    11.4511    14.4445 
   C  85   18.7762    15.6942    18.7163    12.9587    17.6035     3.6056 
   C  86   12.7658     9.1024     6.6932     5.5315     5.5231    12.5852 
   C  87   10.8558     8.9173    15.9796     8.3094    16.8178     6.0266 
   C  88   12.9645     9.3790     5.8953     5.9758     4.5233    13.5851 
   C  89   10.1121     7.9954    14.9867     7.3113    15.8774     6.4641 
   C  90   10.7246     9.1188    16.5943     8.8963    17.5877     6.6921 
   C  91   11.8359     8.1510     6.6913     4.5439     6.0781    12.1162 
   H  92   16.2564    13.7589    18.8995    11.9249    18.6560     0.8743 
   H  93   17.5109    13.7798    11.2961    10.0496     8.7563    11.9450 
   H  94   16.0862    13.8622    19.6103    12.3861    19.5903     2.2900 
   H  95   17.3485    13.6250    12.1061     9.9080     9.8512    10.5955 
   H  96   17.3310    13.6026    10.9405     9.8773     8.3776    12.1708 
   H  97   14.1309    11.5359    16.8210     9.7125    16.7977     2.2901 
   H  98   13.8429    11.3075    16.7807     9.5890    16.8417     2.6009 
   H  99   15.0930    11.3661     9.3078     7.6443     7.3379    11.4895 
   H 100   14.7611    11.0298     9.4247     7.2994     7.6427    11.0055 
   H 101   13.6283    11.4578    17.6730    10.2318    17.9918     3.4662 
   H 102   15.1665    11.4513    10.8475     7.7525     9.1977     9.6102 
   H 103   15.8910    12.1853    11.5775     8.5028     9.7886     9.4377 
   H 104   15.0092    12.9681    19.1988    11.7867    19.4244     3.2657 
   H 105   15.7577    13.6399    19.6339    12.3145    19.7244     2.8113 
   H 106   16.8474    14.0597    18.3622    11.8056    17.7997     0.8743 
   H 107   19.0078    15.2759    12.6081    11.5441     9.8406    12.4569 
   H 108   17.1514    14.3239    18.4609    12.0015    17.8221     1.2347 
   H 109   19.3878    15.6559    12.9171    11.9241    10.0941    12.6565 
   H 110   17.5896    14.5615    17.9763    11.9390    17.0766     2.6009 
   H 111   20.6138    16.9052    12.9125    13.2100     9.6650    14.8948 
   H 112   17.3098    14.9115    20.1295    13.1504    19.8429     1.7732 
   H 113   17.9190    14.2137    13.0763    10.5274    10.8511    10.0773 
   H 114   14.3896    10.6780    10.4480     6.9882     9.0520     9.3942 
   H 115   13.7991    10.0688     9.3748     6.3407     8.0418    10.2331 
   H 116   14.5587    12.6767    19.2283    11.7175    19.6033     4.0250 
   H 117   13.4932    11.6111    18.3087    10.7436    18.8090     4.4070 
   H 118   19.0480    15.3750    10.9730    11.7394     7.7325    14.9142 
   H 119   18.3052    14.6218    10.5299    10.9715     7.4441    14.2721 
   H 120   15.0997    11.9729    15.5323     9.3037    14.9139     3.2657 
   H 121   14.7050    11.6936    15.7386     9.2250    15.2979     2.8114 
   H 122   15.0553    11.3847     7.9862     7.7730     5.7051    13.0932 
   H 123   12.2360     9.7188    15.5727     8.1882    15.9079     4.1886 
   H 124   13.9880    11.1951    16.0307     9.1023    15.8892     2.6200 
   H 125   17.0165    13.3206     9.7575     9.6529     6.9933    13.3306 
   H 126   16.5794    14.4743    20.3878    13.1145    20.3987     2.9560 
   H 127   17.1990    15.1800    21.1818    13.8895    21.1924     3.5888 
   H 128   16.3952    12.7140    12.4063     9.0745    10.6102     8.9224 
   H 129   16.5295    12.8867    13.0545     9.3149    11.3614     8.2003 
   H 130   10.9928     8.3418    14.2563     6.7960    14.7582     5.4575 
   H 131   14.7953    11.2187     6.7549     7.7894     4.2901    14.3104 
   H 132   17.2282    14.0258    16.8345    11.1576    15.7839     3.7042 
   H 133   17.0592    13.7563    16.1483    10.7383    14.9935     4.4769 
   H 134   16.1955    12.9164    15.6058     9.9615    14.6253     4.1763 
   H 135   21.0091    17.3063    13.1264    13.6197     9.8107    15.3375 
   H 136   21.3464    17.6664    13.0287    14.0140     9.5916    16.1753 
   H 137   20.5465    16.8794    12.1548    13.2487     8.7357    15.9453 
   H 138   17.9254    14.7139    17.3540    11.8127    16.1914     4.0130 
   H 139   21.6088    17.8980    13.8243    14.1983    10.5036    15.4490 
   H 140   19.9000    16.1708    13.8305    12.4435    11.0720    12.2260 
   H 141   18.0727    15.2936    19.4311    13.0010    18.7259     1.7732 
   H 142   15.0919    11.8517    14.9716     9.0010    14.2360     4.0250 
   H 143   19.5205    15.8733    11.0346    12.2774     7.6481    15.6981 
   H 144   14.4379    10.9041     6.1682     7.5635     3.7833    14.6149 
   H 145   13.6744    10.1679     5.5352     6.9022     3.5854    14.5676 
   H 146   10.4059     7.7792    13.9121     6.3722    14.5464     6.0397 
   H 147    9.7847     7.3432    13.9665     6.3216    14.8008     6.6349 
   H 148   17.1221    13.5181    13.9435    10.0085    12.2398     7.7315 
   H 149   17.9985    14.3943    14.6187    10.8769    12.7584     8.0274 
   H 150   18.0440    14.3924    14.0892    10.7963    12.0782     8.8427 
   H 151   18.0815    16.0716    21.9970    14.7483    21.9327     4.0750 
   H 152   18.7866    16.6725    22.3241    15.1943    22.1184     4.0601 
   H 153   18.2894    16.0575    21.5195    14.4583    21.2662     3.1879 
   H 154   21.1637    17.4324    14.2884    13.7015    11.2232    13.8673 
   H 155   22.0077    18.2757    15.1360    14.5439    12.0242    14.2345 
   H 156   22.2567    18.5291    14.9425    14.8039    11.7075    15.0252 
   H 157   18.4833    15.4726    18.8031    12.8464    17.8086     3.0148 
   H 158   19.3207    16.2707    19.3318    13.5662    18.1930     3.8242 
   H 159   19.0848    15.9368    18.6498    13.0994    17.4180     4.2048 
   H 160    9.5183     7.5018    14.7551     7.0578    15.7864     7.0841 
   H 161   12.5231     8.9846     5.3173     5.6987     4.2412    13.9055 
   H 162   11.4146     8.5189    13.7782     6.5351    14.0689     5.2858 
   H 163   12.3791     9.5663    14.7450     7.5922    14.8831     4.2163 
   H 164   15.7608    12.2022     7.2302     8.7890     4.3113    14.9330 
   H 165   16.0657    12.4335     8.1614     8.8845     5.3770    14.1275 
   H 166   11.3861     7.6791     6.9682     4.0188     6.6106    11.6789 
   H 167   12.1797     8.4689     7.2940     4.7912     6.5114    11.6196 
   H 168   10.9027     9.4857    17.1304     9.4311    18.1764     6.9768 
   H 169   11.3423     9.6855    17.0051     9.3181    17.8929     6.1944 
   H 170    9.8216     8.6644    16.6937     9.0297    17.9752     8.0984 
   H 171    9.3108     7.8288    15.6634     7.9842    16.9044     7.8654 
   H 172   10.4768     6.8254     6.0257     3.3564     6.2410    12.4831 
   H 173   11.1919     7.6205     5.3139     4.3295     5.1837    13.3183 
   H 174   10.9222     8.1231     1.4157     6.3666     3.8098    17.0868 
   H 175   12.4550    10.2301     1.4158     9.0576     4.1655    19.9111 
   H 176    4.1655     1.4157    10.2300     3.8097    12.4550    12.5924 
   H 177    3.8098     1.4158     8.1231     4.1654    10.9221    14.9797 
   H 178    1.4157     3.8098    12.4550     7.4081    15.2793    15.4034 
   H 179    1.4158     4.1655    10.9221     7.7816    14.1584    17.4907 
   H 180    7.4082     3.8097     6.3665     1.4158     8.1231    13.0659 
   H 181    7.7816     4.1654     9.0575     1.4157    10.2301    10.3794 
   H 182   14.1584    10.9222     4.1655     8.1232     1.4157    16.7058 
   H 183   15.2793    12.4550     3.8098    10.2302     1.4158    19.5126 

              O   7      O   8      O   9      O  10      O  11      O  12
              ------------------------------------------------------------------
   O   7    0.0000 
   O   8    3.4641     0.0000 
   O   9   12.1758    11.7697     0.0000 
   O  10    2.0000     2.0000    12.8420     0.0000 
   O  11   10.8562    10.9605     2.0000    11.7697     0.0000 
   O  12    1.7321     3.0000    13.4579     1.0000    12.2769     0.0000 
   O  13   10.2791    10.6741     3.0000    11.3282     1.0000    11.7697 
   O  14    2.0000     5.2915    13.6617     3.4641    12.1758     2.6458 
   O  15   10.9605    12.1000     5.2915    12.3613     3.4641    12.6095 
   O  16    3.8982     4.8715    15.8518     3.1196    14.6590     2.3942 
   O  17    7.9009     8.5578     4.8715     9.0349     3.1196     9.4247 
   O  18    5.0390     1.7320    11.0514     3.7320    10.5199     4.7320 
   O  19   13.4548    12.6853     1.7320    13.9369     3.7320    14.6252 
   O  20   17.7107    14.8955    12.0701    16.8720    13.6412    17.8622 
   O  21    8.5995     5.5860    15.8893     6.6176    15.5777     7.2860 
   O  22   10.5882     7.5738    17.4154     8.5995    17.2480     9.2328 
   O  23   10.2564     7.6280     8.0973     9.5456     8.7239    10.5160 
   O  24   11.2813     8.2620    10.0154    10.2564    10.7168    11.2543 
   O  25   11.2383     7.8204    15.5125     9.4168    15.6768    10.2681 
   O  26   13.1119     9.7356    17.2896    11.2383    17.5515    12.0440 
   O  27   13.9822    11.2295     9.5759    13.1895    10.8243    14.1737 
   O  28   15.0013    11.9850    11.5717    13.9822    12.7817    14.9810 
   O  29   18.7262    15.7124    13.9770    17.7107    15.4840    18.7099 
   O  30   17.3444    14.3701    12.7551    16.3653    14.1994    17.3634 
   O  31   19.0660    16.1943    13.3548    18.1799    14.9737    19.1738 
   O  32   13.6159    10.6516    10.5563    12.6433    11.6378    13.6401 
   O  33   15.3346    12.5015    10.6849    14.4780    12.0457    15.4685 
   O  34   11.8582     8.5406    16.8762     9.9496    16.9843    10.7248 
   O  35   12.5538     9.1102    15.9612    10.7692    16.2895    11.6390 
   O  36    9.8901     6.9478     9.3827     8.9297     9.8545     9.9234 
   O  37   11.6036     8.8416     8.8226    10.7968     9.6872    11.7800 
   O  38    9.5396     6.7617    17.3023     7.5396    16.9735     8.0875 
   O  39    9.7496     6.5456    16.0123     7.8036    15.8762     8.5395 
   N  40   13.7690    14.2780     4.0000    14.9082     3.4641    15.3118 
   N  41    2.0000     4.0000    10.2562     3.4641     8.8768     3.6055 
   N  42    3.8982     2.3943     9.3990     3.6327     8.5682     4.4642 
   N  43   14.3999    14.1482     2.3942    15.1666     3.6326    15.7466 
   N  44    9.0040    10.3609     6.0000    10.4757     4.0000    10.6741 
   N  45    3.4641     6.0000    15.5468     4.0000    14.1177     3.0000 
   N  46   10.8519    10.0554     2.0000    11.2918     2.8284    11.9875 
   N  47    4.7883     2.0000    13.5624     2.8284    12.8665     3.6055 
   N  48   15.2673    13.9876     4.3589    15.4714     6.3498    16.2549 
   N  49    7.6624     4.3589    10.9269     6.3498    10.8778     7.3471 
   C  50   12.2769    12.6095     2.6458    13.3188     1.7321    13.7691 
   C  51    1.0000     2.6458    11.4914     1.7321    10.2791     2.0000 
   C  52    1.7320     3.0000    10.5130     2.6458     9.2807     3.0000 
   C  53   13.2760    13.5841     3.0000    14.3150     2.6458    14.7688 
   C  54   11.8485    11.9441     1.7320    12.7693     1.0000    13.2760 
   C  55    1.7320     1.7321    11.8485     1.0001    10.7700     1.7321 
   C  56   12.4733    12.3231     1.0000    13.2760     1.7320    13.8365 
   C  57    2.6457     1.0001    11.2779     1.7321    10.3343     2.6458 
   C  58    3.0000     1.7321    10.2791     2.6458     9.3417     3.4641 
   C  59   13.4579    13.3188     1.7321    14.2753     2.6458    14.8317 
   C  60    2.6457     2.6458     9.8654     3.0000     8.7712     3.6056 
   C  61   13.8365    13.9185     2.6458    14.7688     3.0000    15.2746 
   C  62    1.0000     3.6056    13.1445     1.7321    11.8485     1.0001 
   C  63   10.7700    11.4136     3.6055    11.9441     1.7320    12.3231 
   C  64    1.7320     4.5826    13.8555     2.6458    12.4733     1.7321 
   C  65   10.3343    11.2727     4.5826    11.6390     2.6457    11.9441 
   C  66    2.6458     5.0000    14.8157     3.0000    13.4579     2.0000 
   C  67    9.3417    10.3704     5.0000    10.6741     3.0000    10.9605 
   C  68    8.7712     9.5504     4.5826     9.9801     2.6457    10.3344 
   C  69    3.0000     4.5826    15.0944     2.6457    13.8365     1.7320 
   C  70    9.2807     9.7163     3.6055    10.3344     1.7320    10.7701 
   C  71    2.6458     3.6055    14.4445     1.7320    13.2760     1.0000 
   C  72   12.4708    11.7843     0.9999    12.9895     2.9093    13.6622 
   C  73    4.4641     1.0000    11.8397     2.9094    11.1916     3.8983 
   C  74   14.7687    15.2444     4.5826    15.8992     4.3589    16.3089 
   C  75    2.9999     4.5826     9.3091     4.3589     7.8910     4.5826 
   C  76   11.8439    10.9618     1.7320    12.2482     3.2348    12.9594 
   C  77    5.0391     1.7320    12.7628     3.2348    12.1639     4.1468 
   C  78    3.8982     5.5371    16.0483     3.6326    14.7544     2.7320 
   C  79    7.9423     8.9901     5.5372     9.2601     3.6327     9.5506 
   C  80   12.2699    11.1133     2.6458    12.5231     4.2342    13.2849 
   C  81    6.0267     2.6457    12.9438     4.2342    12.4931     5.1374 
   C  82    3.6055     5.5678     9.1829     5.1962     7.6113     5.2915 
   C  83   15.3118    15.9602     5.5678    16.5263     5.1962    16.8913 
   C  84    3.6055     6.5574    15.3742     4.5826    13.8555     3.6056 
   C  85    9.7162    11.2553     6.5574    11.2727     4.5826    11.4136 
   C  86    6.0267     2.6458    11.2601     4.6252    10.8991     5.6204 
   C  87   13.8312    12.8164     2.6457    14.1790     4.6251    14.9143 
   C  88    6.4641     3.0000    12.2268     4.8366    11.8951     5.7956 
   C  89   13.2689    12.0647     3.0000    13.5034     4.8366    14.2735 
   C  90   14.8263    13.7590     3.4641    15.1512     5.4641    15.8960 
   C  91    6.6921     3.4641    10.5707     5.4641    10.3540     6.4641 
   H  92   12.5751    13.0434     3.2380    13.6851     2.2901    14.1017 
   H  93    0.8743     2.6008    12.0999     1.2347    10.8984     1.3800 
   H  94   13.8954    14.1901     3.3533    14.9329     3.2380    15.3886 
   H  95    1.2346     3.3533    10.9412     2.6009     9.6352     2.7431 
   H  96    1.2346     2.2901    12.2300     0.8744    11.0770     1.2347 
   H  97   11.6183    11.5560     1.2347    12.4569     0.8743    12.9996 
   H  98   11.8642    11.7062     0.8743    12.6565     1.2347    13.2198 
   H  99    3.2380     0.8744    10.9550     2.2901    10.1045     3.2380 
   H 100    3.4662     1.3660    10.4257     2.7603     9.5946     3.6737 
   H 101   13.4149    13.1182     1.3660    14.1504     2.7603    14.7413 
   H 102    3.2657     2.8113     9.3444     3.4977     8.3220     4.1712 
   H 103    2.8113     3.2657     9.4633     3.4977     8.2904     4.0024 
   H 104   14.3536    14.3367     2.8113    15.2402     3.4977    15.7678 
   H 105   14.2754    14.4508     3.2657    15.2574     3.4977    15.7407 
   H 106   11.1088    11.8913     4.0601    12.3513     2.2901    12.6938 
   H 107    0.8743     4.0601    12.9852     2.2901    11.6183     1.6200 
   H 108   10.9504    11.8401     4.4187    12.2401     2.6009    12.5554 
   H 109    1.2347     4.4187    13.2632     2.6009    11.8642     1.8397 
   H 110    9.7303    10.8938     5.3371    11.1278     3.3533    11.3756 
   H 111    3.2380     5.3371    15.4136     3.3533    14.0693     2.3716 
   H 112   13.4829    14.1345     4.3433    14.6866     3.5191    15.0550 
   H 113    1.7732     4.3433    10.7236     3.5191     9.2803     3.4849 
   H 114    4.0250     2.9807     8.8689     4.0433     7.9831     4.8042 
   H 115    4.4070     2.3796     9.4171     3.9082     8.7121     4.8042 
   H 116   14.8728    14.7024     2.9807    15.6850     4.0433    16.2464 
   H 117   14.5319    14.1313     2.3796    15.2216     3.9082    15.8335 
   H 118    3.2657     3.8982    14.9896     2.1829    13.8515     1.5968 
   H 119    2.8114     3.1102    14.2543     1.4156    13.1577     1.0813 
   H 120    8.7147     9.0969     3.8982     9.7322     2.1829    10.1831 
   H 121    9.4428     9.6546     3.1102    10.3892     1.4156    10.8764 
   H 122    4.1886     0.8742    12.3440     2.4659    11.6318     3.4262 
   H 123   11.8620    11.2341     0.8742    12.4062     2.4659    13.0678 
   H 124   10.6337    10.5656     1.7732    11.4570     0.6200    12.0033 
   H 125    2.6200     1.7732    13.1038     0.6200    12.1060     1.4158 
   H 126   14.6601    14.9988     4.0630    15.7244     4.0507    16.1680 
   H 127   15.3481    15.7599     4.8385    16.4519     4.8282    16.8763 
   H 128    2.9560     4.0630     9.2251     4.0507     7.9126     4.3997 
   H 129    3.5888     4.8385     8.6891     4.8282     7.2806     5.1245 
   H 130   11.4818    10.4675     2.2901    11.8078     3.5649    12.5440 
   H 131    5.4575     2.2901    13.3406     3.5649    12.7688     4.4091 
   H 132    8.3218     9.5243     5.7363     9.7160     3.7684     9.9622 
   H 133    7.4496     8.6825     6.1363     8.8411     4.2476     9.0860 
   H 134    7.5946     8.4675     5.4024     8.8242     3.6002     9.1624 
   H 135    3.7041     5.7362    15.8791     3.7683    14.5276     2.8015 
   H 136    4.4769     6.1363    16.6426     4.2476    15.3287     3.3521 
   H 137    4.1762     5.4022    16.2394     3.6000    15.0034     2.8015 
   H 138    8.4017     9.8420     6.3328     9.9004     4.3433    10.0793 
   H 139    4.0130     6.3328    16.1368     4.3433    14.7229     3.3533 
   H 140    1.7732     5.2100    13.0843     3.5192    11.5778     2.8292 
   H 141   11.5700    12.6547     5.2100    12.9528     3.5192    13.2133 
   H 142    7.9386     8.3390     4.5212     8.9486     2.9307     9.3994 
   H 143    4.0250     4.5212    15.7605     2.9307    14.6339     2.3796 
   H 144    6.0398     2.8113    13.5183     4.1519    13.0263     4.9905 
   H 145    6.6349     3.2657    13.2884     4.8153    12.9117     5.6963 
   H 146   11.6795    10.4935     2.8113    11.9096     4.1518    12.6769 
   H 147   12.3644    11.0363     3.2657    12.5185     4.8153    13.3106 
   H 148    4.0750     5.6973     8.5646     5.5323     7.0077     5.7167 
   H 149    4.0601     6.1810     9.1587     5.7415     7.5000     5.7745 
   H 150    3.1879     5.5055     9.8013     4.9156     8.2174     4.9081 
   H 151   15.8267    16.3895     5.6973    17.0046     5.5323    17.3904 
   H 152   15.6710    16.4188     6.1810    16.9331     5.7415    17.2715 
   H 153   14.8048    15.5437     5.5056    16.0577     4.9156    16.4004 
   H 154    3.0148     6.0780    14.7607     4.1339    13.2527     3.1880 
   H 155    3.8242     6.9530    15.2992     5.0104    13.7271     4.0601 
   H 156    4.2048     7.0589    15.9883     5.0676    14.4598     4.0751 
   H 157   10.1452    11.5349     6.0780    11.6445     4.1339    11.8264 
   H 158   10.1822    11.8184     6.9530    11.7825     5.0104    11.8913 
   H 159    9.3088    11.0036     7.0589    10.9235     5.0676    11.0202 
   H 160   13.5668    12.2169     3.6199    13.7181     5.4446    14.5139 
   H 161    7.0842     3.6200    12.4099     5.4447    12.1718     6.3965 
   H 162   10.4851     9.5466     2.6200    10.8411     3.2961    11.5640 
   H 163   10.6311    10.0331     1.7733    11.1762     2.2353    11.8335 
   H 164    5.2858     2.6200    14.1294     3.2961    13.4629     3.9829 
   H 165    4.2163     1.7733    13.5158     2.2353    12.7332     2.9871 
   H 166    6.9768     3.8917    10.0294     5.8818     9.8816     6.8790 
   H 167    6.1945     3.1022    10.1976     5.0878     9.8924     6.0842 
   H 168   15.4275    14.3789     3.8917    15.7669     5.8818    16.5081 
   H 169   14.7911    13.8674     3.1021    15.1974     5.0877    15.9150 
   H 170   15.8868    14.5879     4.8707    16.0831     6.8696    16.8700 
   H 171   14.9467    13.5580     4.4726    15.0842     6.4284    15.8867 
   H 172    8.0984     4.8707    10.5684     6.8696    10.6192     7.8693 
   H 173    7.8654     4.4726    11.5430     6.4284    11.4964     7.4152 
   H 174   11.1710     7.7234    14.9848     9.4025    15.1956    10.2852 
   H 175   13.2453     9.9146    17.8055    11.3391    18.0255    12.1125 
   H 176   14.3278    11.6570     9.3217    13.6010    10.6584    14.5787 
   H 177   14.7399    11.6561    11.8624    13.6560    12.9979    14.6559 
   H 178   18.0490    15.2962    11.9665    17.2628    13.5953    18.2488 
   H 179   18.4548    15.3880    14.1371    17.3879    15.5889    18.3878 
   H 180   11.0366     7.9246    10.4611     9.9243    11.0786    10.9242 
   H 181   10.6143     8.1029     7.6452     9.9915     8.3802    10.9506 
   H 182    8.3743     5.2328    15.2990     6.4195    15.0165     7.1501 
   H 183   10.8601     7.9494    17.9921     8.8624    17.7953     9.4454 

              O  13      O  14      O  15      O  16      O  17      O  18
              ------------------------------------------------------------------
   O  13    0.0000 
   O  14   11.4914     0.0000 
   O  15    2.6458    11.7697     0.0000 
   O  16   14.1312     3.6327    14.8535     0.0000 
   O  17    2.3942     9.1004     3.6327    11.7697     0.0000 
   O  18   10.3893     6.9513    12.1383     6.5054     8.5107     0.0000 
   O  19    4.7320    15.0450     6.9513    17.0076     6.5054    11.7697 
   O  20   14.4665    19.7093    17.0924    19.6704    14.8901    13.1896 
   O  21   15.5166     9.9267    17.3115     7.4171    13.6843     5.1736 
   O  22   17.2508    11.8616    19.1447     9.1492    15.5120     7.0328 
   O  23    9.1856    12.2526    11.7213    12.4923     8.6265     6.0109 
   O  24   11.1857    13.2740    13.7161    12.9872    10.5686     6.5377 
   O  25   15.8533    12.8769    18.0327    10.8884    14.4574     6.6176 
   O  26   17.7656    14.6778    19.9868    12.4385    16.4270     8.5995 
   O  27   11.5282    15.9800    14.1718    16.0487    11.5817     9.5456 
   O  28   13.4576    16.9970    16.0950    16.6624    13.3746    10.2564 
   O  29   16.2774    20.7234    18.9162    20.3584    16.5505    13.9823 
   O  30   14.9697    19.3430    17.6133    19.0566    15.1765    12.6434 
   O  31   15.8158    21.0657    18.4321    20.9340    16.2882    14.4780 
   O  32   12.2654    15.6137    14.8879    15.3794    12.0616     8.9298 
   O  33   12.7893    17.3342    15.4350    17.2822    12.9435    10.7969 
   O  34   17.1259    13.3668    19.2463    11.0430    15.6458     7.5396 
   O  35   16.5422    14.2331    18.8210    12.3013    15.2992     7.8037 
   O  36   10.2298    11.8862    12.6858    11.7367     9.4070     5.2426 
   O  37   10.2393    13.6030    12.8292    13.6738     9.8801     7.1684 
   O  38   16.8958    10.6831    18.6457     7.8191    15.0255     6.5231 
   O  39   15.9023    11.1852    17.8478     8.8081    14.2166     5.8030 
   N  40    3.6055    14.8316     3.4641    17.6506     5.8873    13.9426 
   N  41    8.2826     3.4641     9.0041     5.8873     5.9016     5.0919 
   N  42    8.3036     5.8873     9.8566     6.7520     6.2592     2.3943 
   N  43    4.4640    15.7865     5.8872    18.1396     6.7518    13.4454 
   N  44    3.0000     9.7706     2.0000    12.8880     2.3942    10.5707 
   N  45   13.4579     2.0000    13.7691     2.3942    11.0641     7.7320 
   N  46    3.6055    12.4962     6.2392    14.3666     4.5019     9.2044 
   N  47   12.6234     6.2392    14.0979     4.5019    10.5444     2.6458 
   N  48    7.3471    16.9942     9.5934    18.5879     8.9351    12.8164 
   N  49   10.9904     9.5934    13.1269     8.9351     9.5506     2.6458 
   C  50    2.0000    13.4579     3.0000    16.1312     4.3814    12.2284 
   C  51    9.7706     3.0000    10.6741     4.3814     7.4316     4.1144 
   C  52    8.7712     3.6055     9.7163     5.3785     6.4366     4.1468 
   C  53    3.0000    14.4445     3.6055    17.1312     5.3785    13.1656 
   C  54    1.7320    13.1445     3.6056    15.6572     4.0576    11.4659 
   C  55   10.3343     3.6055    11.4136     4.0576     8.0517     3.3460 
   C  56    2.6457    13.8555     4.5826    16.2279     4.8439    11.7132 
   C  57    9.9800     4.5826    11.2727     4.8440     7.7868     2.3941 
   C  58    9.0040     5.0000    10.3704     5.7616     6.8437     2.4495 
   C  59    3.4641    14.8157     5.0000    17.2223     5.7616    12.6885 
   C  60    8.3509     4.5826     9.5504     5.9940     6.1020     3.4252 
   C  61    3.6056    15.0944     4.5826    17.6543     5.9940    13.3815 
   C  62   11.2779     1.7320    11.9441     2.9094     8.9007     5.3032 
   C  63    1.0000    11.8485     1.7321    14.6545     2.9093    11.2251 
   C  64   11.8485     1.0000    12.3231     2.7321     9.4561     6.2919 
   C  65    1.7320    11.2779     1.0001    14.2323     2.7320    11.2370 
   C  66   12.8420     1.7321    13.3188     1.9318    10.4507     6.7320 
   C  67    2.0000    10.2791     1.7321    13.2400     1.9318    10.4150 
   C  68    1.7320     9.8654     2.6458    12.6583     1.0000     9.5083 
   C  69   13.2760     2.6458    13.9185     1.0000    10.9004     6.2919 
   C  70    1.0000    10.5130     3.0000    13.1312     1.4142     9.4942 
   C  71   12.7693     3.0000    13.5841     1.4142    10.4222     5.3032 
   C  72    3.8982    14.0491     6.2763    16.0484     5.5372    10.9306 
   C  73   10.9903     6.2764    12.5880     5.5373     8.9900     0.9998 
   C  74    4.5826    15.8274     4.3589    18.6495     6.8842    14.8726 
   C  75    7.2850     4.3589     8.0339     6.8842     4.9021     5.4033 
   C  76    4.1468    13.4957     6.6975    15.3333     5.3785    10.0384 
   C  77   11.9790     6.6975    13.5878     5.3785     9.9898     1.7320 
   C  78   14.1691     3.1196    14.7141     1.0000    11.7842     7.2282 
   C  79    2.7321     8.9448     3.1197    11.8398     1.0001     9.1114 
   C  80    5.1374    13.9954     7.6974    15.6328     6.2335    10.0556 
   C  81   12.3833     7.6973    14.1307     6.2335    10.5061     1.9999 
   C  82    6.9091     4.5826     7.3626     7.4916     4.5198     6.3975 
   C  83    5.2915    16.2740     4.5826    19.2060     7.4916    15.6609 
   C  84   13.1445     1.7320    13.2760     3.3859    10.7615     8.2774 
   C  85    3.6055    10.3343     1.7321    13.5708     3.3858    11.5241 
   C  86   10.8531     7.9192    12.7431     7.2283     9.1114     1.0001 
   C  87    5.6203    15.4948     7.9191    17.2780     7.2282    11.7842 
   C  88   11.8530     8.2569    13.7315     7.1075    10.0990     1.7320 
   C  89    5.7956    14.9950     8.2569    16.6161     7.1075    10.9620 
   C  90    6.4641    16.4945     8.6395    18.2549     8.1798    12.6854 
   C  91   10.3893     8.6395    12.4204     8.1798     8.8107     1.7321 
   H  92    2.3716    13.6852     2.7431    16.4487     4.6791    12.7177 
   H  93   10.3903     2.7431    11.2717     3.7638     8.0491     4.2150 
   H  94    3.6200    15.0571     4.0601    17.7511     5.9972    13.7510 
   H  95    9.0775     3.0074     9.8688     5.0589     6.7109     4.6463 
   H  96   10.5955     3.0074    11.5437     3.6234     8.2726     3.9482 
   H  97    1.8397    12.9852     4.0601    15.3887     3.9717    11.0123 
   H  98    2.2146    13.2632     4.4187    15.6117     4.2935    11.1108 
   H  99    9.8053     5.1927    11.2293     5.3674     7.6835     1.8299 
   H 100    9.3133     5.4560    10.7927     5.8627     7.2236     1.8295 
   H 101    3.6737    14.8360     5.4560    17.1352     5.8627    12.4168 
   H 102    7.9514     5.1957     9.2894     6.5472     5.7671     3.2584 
   H 103    7.8307     4.6339     8.9580     6.3955     5.5472     3.9711 
   H 104    4.1712    15.6444     5.1957    18.1528     6.5472    13.7427 
   H 105    4.0024    15.4839     4.6339    18.1131     6.3955    13.9477 
   H 106    1.6200    12.1062     1.2347    15.0034     3.3410    11.7562 
   H 107   11.0076     1.2347    11.5560     3.3410     8.6182     5.7168 
   H 108    1.8397    11.8972     0.8743    14.8481     3.2837    11.7606 
   H 109   11.2331     0.8743    11.7062     3.2837     8.8402     6.0859 
   H 110    2.3716    10.5750     1.2347    13.6250     2.5358    10.9853 
   H 111   13.4585     2.2901    13.9364     1.5565    11.0678     7.0624 
   H 112    3.4849    14.4810     2.9435    17.3748     5.6519    13.8733 
   H 113    8.6422     2.9435     9.2021     5.6519     6.2494     5.5624 
   H 114    7.6984     5.9720     9.2370     7.1452     5.6398     2.9807 
   H 115    8.5153     6.4057    10.1949     7.0138     6.5721     1.9501 
   H 116    4.8042    16.2191     5.9720    18.6374     7.1452    14.0275 
   H 117    4.8042    15.9744     6.4057    18.2276     7.0138    13.3583 
   H 118   13.3587     3.4977    14.1990     0.9736    11.0191     5.5401 
   H 119   12.6922     3.4978    13.6247     1.7679    10.3739     4.7728 
   H 120    1.5968     9.9954     3.4977    12.5510     0.9736     8.8803 
   H 121    1.0813    10.7652     3.4978    13.2546     1.7679     9.3234 
   H 122   11.3913     5.9043    12.8979     4.9432     9.3287     1.6199 
   H 123    3.4262    13.4319     5.9043    15.4563     4.9432    10.4246 
   H 124    1.4158    12.0294     4.0130    14.3934     3.1085    10.0545 
   H 125   11.7038     4.0130    12.8278     3.1085     9.4449     3.4639 
   H 126    4.3997    15.7864     4.5429    18.5247     6.7592    14.5645 
   H 127    5.1245    16.4273     4.9779    19.2236     7.4542    15.3471 
   H 128    7.3731     4.5429     8.3136     6.7592     5.0260     4.8020 
   H 129    6.6904     4.9779     7.5335     7.4542     4.3167     5.4738 
   H 130    4.4091    13.1791     7.0177    14.9065     5.3720     9.4961 
   H 131   12.5928     7.0177    14.2077     5.3720    10.6096     2.2901 
   H 132    2.8016     9.2163     2.6489    12.2183     1.5679     9.6945 
   H 133    3.3521     8.3831     3.5257    11.3471     1.4158     8.9130 
   H 134    2.8016     8.7089     3.6355    11.4823     0.5573     8.5335 
   H 135   13.9105     2.6489    14.3577     1.5678    11.5187     7.4543 
   H 136   14.7298     3.5257    15.2196     1.4158    12.3412     7.8168 
   H 137   14.4497     3.6354    15.0876     0.5572    12.0758     7.0497 
   H 138    3.3533     9.1510     2.6200    12.2810     2.2456    10.1159 
   H 139   14.0693     2.6200    14.3889     2.2456    11.6753     8.0599 
   H 140   10.8843     0.6200    11.1500     4.1394     8.4951     6.8111 
   H 141    2.8292    12.3894     0.6200    15.4646     4.1394    12.6490 
   H 142    2.3796     9.2499     4.0433    11.7687     0.6200     8.1777 
   H 143   14.1431     4.0433    14.9729     0.6200    11.8033     6.0966 
   H 144   12.8902     7.6035    14.5787     5.8653    10.9645     2.5068 
   H 145   12.8365     8.2791    14.6405     6.6585    11.0105     2.5068 
   H 146    4.9904    13.4215     7.6034    15.0210     5.8652     9.4394 
   H 147    5.6963    14.1349     8.2791    15.6362     6.6585     9.9008 
   H 148    6.3234     5.1724     6.8943     7.9732     3.9301     6.3661 
   H 149    6.7405     4.8212     6.9861     7.9084     4.3817     7.0147 
   H 150    7.5003     4.0019     7.8520     7.0318     5.1166     6.4883 
   H 151    5.7167    16.8234     5.1724    19.7167     7.9732    16.0403 
   H 152    5.7745    16.5751     4.8212    19.5688     7.9084    16.1613 
   H 153    4.9081    15.7298     4.0018    18.7019     7.0318    15.2971 
   H 154   12.5504     1.1121    12.7302     3.3757    10.1642     7.7845 
   H 155   12.9852     1.8397    12.9996     4.0028    10.6171     8.6565 
   H 156   13.7410     2.3521    13.8280     3.5076    11.3614     8.7866 
   H 157    3.1879    10.8381     1.1121    14.0188     3.3756    11.7183 
   H 158    4.0601    10.7159     1.8397    14.0133     4.0028    12.1191 
   H 159    4.0751     9.8437     2.3521    13.1367     3.5075    11.3606 
   H 160    6.3964    15.3294     8.8727    16.8365     7.6352    11.0454 
   H 161   12.1748     8.8727    14.1248     7.6353    10.4966     2.2901 
   H 162    3.9829    12.1791     6.6287    13.9324     4.5626     8.6456 
   H 163    2.9871    12.2174     5.6240    14.2224     3.9669     9.2807 
   H 164   13.2307     6.6287    14.7174     4.5626    11.1613     3.1408 
   H 165   12.4445     5.6240    13.8219     3.9669    10.3076     2.8292 
   H 166    9.9587     8.9513    12.0604     8.6841     8.4756     2.1829 
   H 167    9.8892     8.1630    11.8695     7.9195     8.2501     1.4157 
   H 168    6.8790    17.0836     8.9513    18.8691     8.6841    13.3034 
   H 169    6.0841    16.4144     8.1629    18.2872     7.9194    12.8567 
   H 170    7.8693    17.6139    10.0525    19.2004     9.5158    13.3998 
   H 171    7.4152    16.7068     9.7563    18.2034     8.8616    12.3462 
   H 172   10.7845    10.0525    12.9963     9.5158     9.4603     3.1408 
   H 173   11.6031     9.7563    13.7224     8.8616    10.1362     2.8292 
   H 174   15.3977    12.8665    17.6160    11.0383    14.0611     6.4196 
   H 175   18.2171    14.7552    20.4043    12.3871    16.8273     8.8624 
   H 176   11.3998    16.3213    14.0455    16.4966    11.5813     9.9915 
   H 177   13.6403    16.7297    16.2672    16.2808    13.4498     9.9243 
   H 178   14.4448    20.0448    17.0558    20.0952    14.9672    13.6011 
   H 179   16.3582    20.4482    19.0021    19.9895    16.5416    13.6561 
   H 180   11.5059    13.0191    14.0007    12.5862    10.7716     6.1930 
   H 181    8.8948    12.6030    11.4678    12.9739     8.4907     6.5213 
   H 182   14.9738     9.7958    16.8083     7.4824    13.1774     4.6766 
   H 183   17.7806    12.0536    19.6391     9.2057    16.0077     7.5077 

              O  19      O  20      O  21      O  22      O  23      O  24
              ------------------------------------------------------------------
   O  19    0.0000 
   O  20   10.8244     0.0000 
   O  21   16.3531    14.6613     0.0000 
   O  22   17.7423    14.8361     2.0000     0.0000 
   O  23    7.9311     7.4641     9.1278    10.1686     0.0000 
   O  24    9.7047     6.6921     8.4399     9.1278     2.0000     0.0000 
   O  25   15.5777    11.6278     3.7321     3.2349     7.6995     6.3034 
   O  26   17.2480    12.1584     5.0391     3.7321     9.3183     7.6995 
   O  27    8.7239     3.7321    11.6278    12.1584     3.7320     3.2348 
   O  28   10.7168     3.2349    11.4274    11.6278     5.0390     3.7320 
   O  29   12.7818     2.0000    14.7580    14.6613     8.6395     7.4641 
   O  30   11.6379     1.4142    13.6770    13.7192     7.2283     6.1091 
   O  31   12.0457     1.4142    15.6746    15.7114     8.8377     7.9484 
   O  32    9.8545     4.3198    10.4902    10.8933     3.6326     2.3942 
   O  33    9.6873     2.3941    12.4800    12.8207     5.1112     4.3198 
   O  34   16.9735    12.8207     3.6326     2.3942     9.1094     7.7092 
   O  35   15.8762    10.8933     5.1112     4.3198     7.9455     6.2914 
   O  36    9.3080     7.9485     7.8029     8.7733     1.4142     1.4143 
   O  37    8.3930     6.1091     9.6780    10.4761     1.4142     1.4143 
   O  38   17.7649    15.7114     1.4142     1.4142    10.4760     9.6779 
   O  39   16.3284    13.7191     1.4142     1.4143     8.7732     7.8029 
   N  40    5.0919    15.9068    19.0295    20.7111    11.9604    13.9210 
   N  41   11.5978    16.7297     9.5666    11.5620     9.2917    10.6023 
   N  42   10.3795    13.8325     7.4993     9.4021     6.3699     7.5267 
   N  43    2.3942    13.0791    18.2597    19.7547    10.1917    12.0255 
   N  44    7.7320    17.0551    15.7181    17.6036    11.0085    12.9587 
   N  45   16.8783    20.8385     9.6420    11.4511    13.4530    14.2498 
   N  46    2.6458    10.8612    13.9438    15.4379     6.1518     8.1030 
   N  47   14.3642    15.3483     3.8179     5.8144     8.4781     8.6617 
   N  48    2.6458     8.8293    16.9070    18.0633     7.9042     9.3181 
   N  49   11.2601    10.7712     5.1432     6.4976     4.1193     4.0805 
   C  50    4.1144    14.7158    17.3030    18.9796    10.3237    12.3013 
   C  51   12.7032    16.7115     8.0409    10.0407     9.2589    10.2860 
   C  52   11.7521    16.1982     8.5698    10.5641     8.7349     9.9183 
   C  53    4.1468    14.9396    18.2129    19.8630    10.9854    12.9392 
   C  54    3.3460    13.7739    16.4918    18.1331     9.3384    11.3115 
   C  55   12.9605    16.2718     7.0412     9.0409     8.8707     9.7347 
   C  56    2.3941    13.0200    16.6398    18.2129     9.0519    10.9854 
   C  57   12.3010    15.2767     6.5790     8.5699     7.8882     8.7349 
   C  58   11.3160    14.7134     7.2158     9.1776     7.2660     8.2987 
   C  59    2.4495    13.2725    17.5841    19.1318     9.8000    11.6954 
   C  60   11.0205    15.1982     8.1943    10.1640     7.7351     8.9390 
   C  61    3.4252    14.2476    18.3470    19.9359    10.7429    12.6552 
   C  62   14.3977    18.2636     8.2563    10.2140    10.8454    11.7344 
   C  63    5.3032    15.3661    16.3761    18.1385    10.1856    12.1856 
   C  64   15.1642    19.2602     8.9700    10.8913    11.8359    12.7343 
   C  65    6.2919    16.1961    16.4096    18.2237    10.7246    12.7185 
   C  66   16.1002    19.8456     8.8133    10.6693    12.4707    13.2511 
   C  67    6.7320    16.1764    15.5872    17.4295    10.3400    12.3150 
   C  68    6.2919    15.3246    14.6815    16.5038     9.3566    11.3264 
   C  69   16.3040    19.4768     7.9117     9.7342    12.1853    12.8279 
   C  70    5.3032    14.4445    14.6441    16.4097     8.7336    10.7247 
   C  71   15.5936    18.4920     7.0924     8.9700    11.2256    11.8359 
   C  72    0.9999    11.0904    15.6186    17.0676     7.4703     9.3319 
   C  73   12.6321    14.1365     4.8300     6.7841     7.0057     7.4626 
   C  74    5.4033    16.2069    19.9358    21.5932    12.6551    14.5909 
   C  75   10.6886    16.3091    10.1639    12.1435     8.9390    10.3913 
   C  76    1.7320    10.4468    14.6600    16.0878     6.4763     8.3521 
   C  77   13.5011    14.3767     3.8748     5.8519     7.4784     7.6859 
   C  78   17.2780    20.4178     8.4153    10.1477    13.1564    13.7537 
   C  79    7.2283    15.8850    14.2731    16.1415     9.5973    11.5261 
   C  80    2.0000     9.4575    14.4701    15.8057     5.9313     7.7156 
   C  81   13.5622    13.6986     3.1842     5.0897     7.0583     7.0357 
   C  82   10.6604    16.9260    11.1528    13.1356     9.6407    11.1811 
   C  83    6.3975    17.1901    20.7570    22.4428    13.6207    15.5649 
   C  84   16.7713    21.2543    10.5380    12.3777    13.8210    14.7341 
   C  85    8.2774    17.9084    16.6574    18.5553    11.9815    13.9391 
   C  86   11.8398    12.4471     4.6787     6.4125     5.4795     5.7594 
   C  87    1.0000     9.8730    16.1830    17.4869     7.4926     9.1627 
   C  88   12.7627    12.7190     3.6847     5.4170     6.0720     6.0457 
   C  89    1.7320     9.1442    15.2602    16.5321     6.5023     8.1628 
   C  90    1.7321     9.7286    16.9817    18.2285     8.1387     9.6981 
   C  91   11.0514    11.4914     5.3224     6.8963     4.4804     4.8187 
   H  92    4.6353    15.3035    17.8156    19.5116    10.9359    12.9157 
   H  93   13.2966    17.0514     7.7597     9.7536     9.6217    10.5552 
   H  94    4.2856    15.1100    18.7816    20.4161    11.4204    13.3570 
   H  95   12.2247    16.8181     8.8515    10.8511     9.3547    10.5274 
   H  96   13.3906    16.8891     7.3814     9.3746     9.4817    10.3546 
   H  97    2.9405    13.1942    15.9997    17.6164     8.7294    10.6988 
   H  98    2.5632    12.9000    16.0578    17.6477     8.6139    10.5689 
   H  99   11.9159    14.6601     6.3550     8.3250     7.2814     8.1150 
   H 100   11.3828    14.3034     6.6731     8.6194     6.8878     7.8180 
   H 101    1.8295    12.6528    17.2479    18.7597     9.3015    11.1743 
   H 102   10.4605    14.6197     8.2301    10.1717     7.1610     8.4216 
   H 103   10.6795    15.3251     8.8075    10.7732     7.8801     9.1924 
   H 104    3.2584    14.0235    18.6578    20.2116    10.8522    12.7312 
   H 105    3.9711    14.7751    18.9334    20.5337    11.3627    13.2735 
   H 106    5.7168    15.9298    16.9168    18.6946    10.8057    12.8057 
   H 107   14.2901    18.5353     8.8611    10.8240    11.0901    12.0642 
   H 108    6.0859    16.2393    16.9291    18.7260    11.0020    13.0011 
   H 109   14.5882    18.9147     9.1209    11.0721    11.4685    12.4435 
   H 110    7.0624    16.7128    16.1542    18.0074    10.9513    12.9288 
   H 111   16.6843    20.2249     8.7723    10.5769    12.8875    13.5986 
   H 112    5.5624    16.3455    18.9923    20.7069    12.1631    14.1395 
   H 113   12.1022    17.3485     9.8512    11.8510     9.9080    11.2019 
   H 114    9.9020    13.8379     8.1108    10.0046     6.3816     7.6777 
   H 115   10.3060    13.3037     7.1180     8.9821     5.8516     6.9404 
   H 116    2.9807    13.5664    18.8627    20.3661    10.8100    12.6391 
   H 117    1.9501    12.5022    18.0953    19.5479     9.8553    11.6500 
   H 118   16.1114    18.7156     6.8310     8.6557    11.5207    12.0375 
   H 119   15.3520    17.9591     6.5028     8.3991    10.7372    11.2899 
   H 120    5.5401    14.2519    14.0343    15.8079     8.3150    10.2948 
   H 121    4.7728    13.8330    14.4418    16.1707     8.2268    10.2236 
   H 122   13.1767    14.7272     4.7119     6.7005     7.6233     8.0451 
   H 123    1.6199    11.2967    15.1783    16.6657     7.2394     9.1481 
   H 124    3.4639    13.0794    15.0763    16.7225     8.1068    10.0987 
   H 125   14.1405    16.6523     6.0056     7.9842     9.4011     9.9987 
   H 126    4.8020    15.5952    19.5924    21.2217    12.1567    14.0783 
   H 127    5.4738    16.2097    20.3836    22.0170    12.9357    14.8494 
   H 128   10.5378    15.7945     9.6262    11.5971     8.3949     9.8091 
   H 129   10.0719    15.8905    10.3821    12.3442     8.5741    10.1006 
   H 130    2.2901    10.0770    14.0687    15.4816     5.8612     7.7473 
   H 131   14.0486    14.5581     3.2961     5.2865     7.8215     7.8850 
   H 132    7.4544    16.3932    14.8486    16.7269    10.1923    12.1287 
   H 133    7.8168    16.2537    14.0496    15.9443     9.7949    11.6912 
   H 134    7.0498    15.3851    13.7013    15.5587     9.0056    10.9254 
   H 135   17.1523    20.6311     8.9404    10.7037    13.3123    13.9919 
   H 136   17.8833    21.0040     8.7704    10.4441    13.7607    14.3328 
   H 137   17.4248    20.2212     7.9040     9.5996    13.0281    13.5398 
   H 138    8.0599    17.0911    15.2436    17.1451    10.8530    12.7786 
   H 139   17.4541    21.2146     9.6367    11.3924    13.8627    14.5948 
   H 140   14.4857    19.3878    10.0941    12.0536    11.9241    13.0191 
   H 141    6.8111    17.1514    17.8221    19.6391    12.0015    14.0007 
   H 142    6.0966    14.2736    13.3438    15.1418     8.0283     9.9792 
   H 143   16.8676    19.2186     6.7986     8.5304    12.1038    12.5285 
   H 144   14.1604    14.2328     2.8027     4.7721     7.6674     7.5910 
   H 145   13.8417    13.4872     2.6821     4.5296     7.0726     6.8746 
   H 146    2.5068     9.4904    13.8854    15.2444     5.4639     7.3046 
   H 147    2.5068     8.8501    14.1798    15.4616     5.4781     7.2054 
   H 148   10.0406    16.4519    11.2577    13.2248     9.2267    10.8262 
   H 149   10.6900    17.3264    11.7668    13.7513    10.1010    11.6869 
   H 150   11.2803    17.4093    11.0817    13.0753    10.0758    11.5584 
   H 151    6.3661    17.0911    21.1100    22.7697    13.7892    15.7126 
   H 152    7.0147    17.8006    21.2737    22.9756    14.2217    16.1704 
   H 153    6.4884    17.3109    20.4167    22.1285    13.4786    15.4408 
   H 154   16.1532    20.6979    10.2899    12.1672    13.2549    14.2045 
   H 155   16.7346    21.5314    11.1023    12.9577    14.0801    15.0600 
   H 156   17.3895    21.8142    10.8160    12.6153    14.3916    15.2707 
   H 157    7.7844    17.6011    16.8740    18.7500    11.8600    13.8348 
   H 158    8.6565    18.4449    17.2433    19.1479    12.5870    14.5484 
   H 159    8.7866    18.2317    16.4613    18.3794    12.1336    14.0701 
   H 160    2.2900     8.5459    15.2009    16.4121     6.3017     7.8686 
   H 161   12.8661    12.3124     3.4898     5.0791     5.8913     5.6782 
   H 162    3.1408    10.5355    13.3439    14.8261     5.5565     7.5194 
   H 163    2.8292    11.4803    14.1239    15.6694     6.6077     8.5804 
   H 164   14.9008    15.5383     3.3236     5.3037     8.8174     8.8738 
   H 165   14.3850    15.7796     4.3845     6.3720     8.7914     9.0874 
   H 166   10.4690    11.0083     5.8874     7.3987     3.8927     4.3758 
   H 167   10.7593    11.7935     5.7063     7.3645     4.6001     5.1720 
   H 168    2.1829     9.9032    17.5787    18.8084     8.6957    10.2117 
   H 169    1.4156    10.3468    17.2622    18.5561     8.5264    10.1467 
   H 170    3.1408     8.8219    17.4325    18.5561     8.3882     9.7320 
   H 171    2.8292     8.3142    16.3590    17.4902     7.3244     8.7092 
   H 172   10.8270    10.1715     5.6629     6.9163     3.5248     3.4794 
   H 173   11.8588    10.9557     4.5893     5.8890     4.5801     4.3025 
   H 174   15.0165    11.0446     4.0776     3.7951     7.1195     5.6902 
   H 175   17.7953    12.7694     4.9702     3.4640     9.8709     8.2852 
   H 176    8.3802     3.4640    12.2146    12.7694     4.0775     3.7950 
   H 177   11.0786     3.7951    10.8905    11.0446     4.9702     3.4639 
   H 178   10.6585     0.6200    15.2072    15.4161     7.7926     7.1440 
   H 179   12.9979     2.3716    14.2654    14.1216     8.4639     7.1742 
   H 180   10.2167     7.1440     7.8462     8.5093     2.3716     0.6200 
   H 181    7.3967     7.1742     9.7464    10.7851     0.6200     2.3716 
   H 182   15.7461    14.1216     0.6200     2.3716     8.5093     7.8462 
   H 183   18.3379    15.4161     2.3716     0.6200    10.7851     9.7464 

              O  25      O  26      O  27      O  28      O  29      O  30
              ------------------------------------------------------------------
   O  25    0.0000 
   O  26    2.0000     0.0000 
   O  27    9.1277    10.1686     0.0000 
   O  28    8.4398     9.1277     2.0000     0.0000 
   O  29   11.4274    11.6278     5.0391     3.7321     0.0000 
   O  30   10.4902    10.8933     3.6327     2.3943     1.4142     0.0000 
   O  31   12.4799    12.8207     5.1112     4.3198     1.4143     2.0000 
   O  32    7.8029     8.7733     1.4142     1.4142     5.1112     3.7321 
   O  33    9.6780    10.4761     1.4143     1.4143     3.6327     2.2361 
   O  34    1.4142     1.4143    10.4760     9.6779    12.4799    11.6279 
   O  35    1.4142     1.4143     8.7732     7.8028    10.4901     9.6696 
   O  36    6.2915     7.9456     4.3198     5.1112     8.8378     7.4642 
   O  37    7.7092     9.1094     2.3941     3.6327     7.2284     5.8187 
   O  38    4.3198     5.1112    12.8206    12.4799    15.6745    14.6613 
   O  39    2.3942     3.6327    10.8933    10.4901    13.6769    12.6618 
   N  40   19.1107    20.9645    13.5687    15.5665    17.8521    16.6743 
   N  41   11.6792    13.6392    13.0069    14.2379    17.9132    16.5077 
   N  42    8.9292    10.9250    10.1009    11.2057    14.9111    13.5164 
   N  43   17.7517    19.4786    11.1148    13.1052    15.0578    13.9571 
   N  44   16.7336    18.7164    13.8601    15.6942    18.7762    17.4209 
   N  45   12.9503    14.6059    17.1372    17.9784    21.7082    20.3586 
   N  46   13.5129    15.2959     7.9985     9.9627    12.6771    11.3801 
   N  47    6.6732     8.4396    11.8235    12.2640    15.9262    14.6536 
   N  48   15.5465    17.0175     7.5025     9.3863    10.8275     9.8369 
   N  49    4.9078     6.8788     7.2502     7.7273    11.4293    10.1215 
   C  50   17.3923    19.2558    12.1507    14.1367    16.6201    15.3893 
   C  51   10.4661    12.3759    12.9835    14.0039    17.7278    16.3452 
   C  52   10.7048    12.6576    12.4663    13.5996    17.3027    15.9061 
   C  53   18.1955    20.0342    12.5701    14.5676    16.8779    15.6907 
   C  54   16.4726    18.3204    11.1595    13.1431    15.6649    14.4220 
   C  55    9.5252    11.4172    12.5619    13.4662    17.1981    15.8323 
   C  56   16.3946    18.1955    10.5736    12.5701    14.9396    13.7305 
   C  57    8.7733    10.7049    11.5703    12.4663    16.1982    14.8324 
   C  58    9.0567    11.0294    10.9868    12.0104    15.7317    14.3471 
   C  59   17.2444    19.0174    11.0531    13.0529    15.2260    14.0676 
   C  60   10.0416    12.0191    11.4664    12.6102    16.3091    14.9111 
   C  61   18.1249    19.9200    12.0529    14.0528    16.2070    15.0576 
   C  62   11.1466    12.9564    14.5486    15.4661    19.1980    17.8322 
   C  63   16.8068    18.7286    12.4901    14.4295    17.1985    15.9036 
   C  64   12.0002    13.7705    15.5432    16.4660    20.1980    18.8322 
   C  65   17.0597    19.0085    13.2188    15.1309    17.9996    16.6851 
   C  66   12.0395    13.7322    16.1479    16.9791    20.7087    19.3601 
   C  67   16.3844    18.3505    13.0525    14.9189    17.9262    16.5838 
   C  68   15.4047    17.3666    12.1353    13.9811    17.0445    15.6904 
   C  69   11.2312    12.8749    15.8109    16.5385    20.2571    18.9291 
   C  70   15.1243    17.0598    11.3371    13.2188    16.1962    14.8567 
   C  71   10.3141    12.0002    14.8342    15.5432    19.2602    17.9346 
   C  72   15.0215    16.7473     8.6875    10.6872    13.0079    11.8013 
   C  73    6.8424     8.7737    10.5134    11.1627    14.8788    13.5548 
   C  74   19.9199    21.7507    14.0527    16.0526    18.1751    17.0411 
   C  75   12.0190    14.0028    12.6102    13.9483    17.5781    16.1661 
   C  76   14.0222    15.7476     7.8492     9.8432    12.3239    11.0760 
   C  77    6.2052     8.0746    10.8341    11.3132    14.9921    13.7058 
   C  78   11.8670    13.4331    16.7648    17.4527    21.1634    19.8456 
   C  79   15.2297    17.2115    12.5814    14.3701    17.5501    16.1765 
   C  80   13.5877    15.2488     6.9558     8.9553    11.3456    10.1120 
   C  81    5.2120     7.0990    10.2375    10.5808    14.2219    12.9645 
   C  82   13.0103    14.9964    13.2585    14.6740    18.2618    16.8477 
   C  83   20.8315    22.6769    15.0527    17.0526    19.1617    18.0344 
   C  84   13.7667    15.4643    17.5343    18.4659    22.1979    20.8321 
   C  85   17.7245    19.7091    14.7717    16.6256    19.6566    18.3118 
   C  86    5.6967     7.6907     8.8627     9.4424    13.1531    11.8359 
   C  87   15.1878    16.7938     7.9297     9.9075    11.8414    10.7246 
   C  88    4.9132     6.8826     9.2408     9.6197    13.2810    12.0084 
   C  89   14.2004    15.7972     7.0014     8.9908    11.0858     9.9209 
   C  90   15.8332    17.3797     8.1556    10.0892    11.7213    10.6858 
   C  91    5.6944     7.6890     7.8825     8.5290    12.2526    10.9183 
   H  92   17.9668    19.8388    12.7658    14.7531    17.2148    15.9910 
   H  93   10.3639    12.2390    13.3317    14.2840    18.0143    16.6418 
   H  94   18.7029    20.5264    12.8623    14.8623    17.0652    15.9063 
   H  95   11.1412    13.0763    13.0863    14.2137    17.9190    16.5233 
   H  96   10.0132    11.8797    13.1773    14.0862    17.8181    16.4523 
   H  97   15.9073    17.7441    10.5459    12.5277    15.0757    13.8246 
   H  98   15.8766    17.6952    10.3139    12.3022    14.7933    13.5544 
   H  99    8.3334    10.2873    10.9562    11.8464    15.5782    14.2125 
   H 100    8.4388    10.4135    10.5871    11.5425    15.2707    13.8948 
   H 101   16.8044    18.5549    10.4583    12.4575    14.6072    13.4519 
   H 102    9.8526    11.8434    10.8894    12.0701    15.7578    14.3561 
   H 103   10.5860    12.5705    11.5995    12.8225    16.4982    15.0931 
   H 104   18.3212    20.0880    11.9702    13.9665    15.9968    14.8795 
   H 105   18.7398    20.5378    12.6404    14.6396    16.7423    15.6087 
   H 106   17.4008    19.3277    13.0894    15.0339    17.7739    16.4866 
   H 107   11.7010    13.5284    14.8102    15.7912    19.5202    18.1445 
   H 108   17.4940    19.4312    13.3585    15.2937    18.0728    16.7775 
   H 109   12.0175    13.8306    15.1894    16.1708    19.9000    18.5244 
   H 110   16.9930    18.9614    13.6270    15.5043    18.4789    17.1436 
   H 111   12.1055    13.7450    16.5420    17.3186    21.0430    19.7057 
   H 112   19.1946    21.0705    13.9151    15.9084    18.2780    17.0800 
   H 113   12.1061    14.0507    13.6250    14.8465    18.5260    17.1213 
   H 114    9.4486    11.4476    10.1082    11.3076    14.9879    13.5844 
   H 115    8.3755    10.3743     9.5753    10.6338    14.3473    12.9572 
   H 116   18.3714    20.0985    11.6843    13.6704    15.5521    14.4734 
   H 117   17.4682    19.1646    10.6202    12.6035    14.4855    13.4011 
   H 118   10.1757    11.8012    15.0854    15.7229    19.4262    18.1169 
   H 119    9.6962    11.3903    14.3171    14.9872    18.6984    17.3802 
   H 120   14.5622    16.5061    11.0543    12.9037    15.9652    14.6098 
   H 121   14.7821    16.7004    10.7511    12.6449    15.5924    14.2575 
   H 122    7.0498     8.9364    11.1164    11.7323    15.4412    14.1260 
   H 123   14.7002    16.4598     8.7226    10.7157    13.1842    11.9436 
   H 124   15.1023    16.9674    10.2209    12.1735    14.9084    13.6151 
   H 125    8.8678    10.6668    12.9965    13.7102    17.4305    16.1003 
   H 126   19.4854    21.2989    13.4747    15.4740    17.5656    16.4379 
   H 127   20.2808    22.0915    14.1815    16.1788    18.1895    17.0859 
   H 128   11.4136    13.4001    12.0848    13.3884    17.0335    15.6231 
   H 129   12.0580    14.0517    12.2100    13.6034    17.2030    15.7892 
   H 130   13.4028    15.1278     7.3499     9.3355    11.9223    10.6486 
   H 131    5.8613     7.6748    11.0737    11.4494    15.0951    13.8348 
   H 132   15.8435    17.8266    13.1294    14.9354    18.0800    16.7129 
   H 133   15.1533    17.1439    12.8892    14.6403    17.8844    16.5011 
   H 134   14.6163    16.5966    12.0404    13.8094    17.0262    15.6463 
   H 135   12.3391    13.9411    16.9558    17.7064    21.4272    20.0959 
   H 136   12.2856    13.8043    17.3589    18.0241    21.7294    20.4179 
   H 137   11.4091    12.9348    16.5947    17.2175    20.9146    19.6118 
   H 138   16.3596    18.3491    13.8209    15.6200    18.7760    17.4076 
   H 139   13.0354    14.6391    17.5268    18.3163    22.0414    20.7026 
   H 140   12.9171    14.7552    15.6559    16.7297    20.4482    19.0598 
   H 141   18.4609    20.4043    14.3239    16.2672    19.0021    17.7184 
   H 142   13.9932    15.9527    10.9620    12.7577    15.9309    14.5566 
   H 143   10.2838    11.8223    15.6204    16.1841    19.8682    18.5777 
   H 144    5.2778     7.0879    10.8052    11.0927    14.7083    13.4688 
   H 145    4.6092     6.4833    10.1012    10.3314    13.9310    12.7014 
   H 146   13.0775    14.7673     6.7847     8.7749    11.3357    10.0642 
   H 147   13.1657    14.7916     6.3433     8.3433    10.7313     9.4935 
   H 148   12.9465    14.9410    12.8050    14.2656    17.8232    16.4091 
   H 149   13.6255    15.6128    13.6817    15.1396    18.6999    17.2858 
   H 150   13.1032    15.0771    13.7249    15.0968    18.7106    17.2974 
   H 151   21.0885    22.9132    15.0730    17.0705    19.0729    17.9745 
   H 152   21.4005    23.2542    15.6726    17.6725    19.7741    18.6504 
   H 153   20.5900    22.4553    15.0579    17.0572    19.2701    18.1153 
   H 154   13.4293    15.1648    16.9740    17.9348    21.6657    20.2947 
   H 155   14.2845    16.0047    17.8043    18.7886    22.5185    21.1440 
   H 156   14.1233    15.7826    18.0986    19.0026    22.7346    21.3741 
   H 157   17.8161    19.7915    14.5361    16.4167    19.3770    18.0458 
   H 158   18.3394    20.3250    15.3425    17.2070    20.2080    18.8697 
   H 159   17.6542    19.6459    15.0293    16.8549    19.9516    18.5948 
   H 160   13.9942    15.5432     6.5149     8.4918    10.4959     9.3481 
   H 161    4.3281     6.3100     8.9007     9.1772    12.8085    11.5572 
   H 162   12.8931    14.6781     7.5503     9.4941    12.3123    10.9929 
   H 163   13.8442    15.6580     8.5908    10.5464    13.2924    11.9914 
   H 164    6.4033     8.0962    12.0691    12.4147    16.0426    14.7954 
   H 165    7.2929     9.0570    12.2152    12.7267    16.4078    15.1198 
   H 166    5.9821     7.9579     7.3647     8.1054    11.8366    10.4847 
   H 167    6.2956     8.2929     8.1360     8.9021    12.6334    11.2806 
   H 168   16.3813    17.9042     8.5391    10.4424    11.9023    10.9181 
   H 169   16.2257    17.8067     8.7149    10.6617    12.3387    11.2962 
   H 170   15.9917    17.4251     7.7566     9.5906    10.8215     9.8932 
   H 171   14.9488    16.4079     6.8890     8.7821    10.3081     9.2866 
   H 172    5.0690     6.9947     6.6342     7.1525    10.8659     9.5459 
   H 173    4.3239     6.3071     7.5215     7.8467    11.5104    10.2352 
   H 174    0.6200     2.3716     8.5093     7.8462    10.8905     9.9255 
   H 175    2.3716     0.6200    10.7850     9.7464    12.2146    11.4979 
   H 176    9.7464    10.7850     0.6200     2.3716     4.9702     3.6001 
   H 177    7.8462     8.5093     2.3716     0.6200     4.0776     2.8243 
   H 178   12.2146    12.7694     4.0776     3.7951     2.3716     2.0194 
   H 179   10.8905    11.0446     4.9702     3.4640     0.6200     1.3894 
   H 180    5.6902     7.1195     3.7950     4.0775     7.7926     6.4714 
   H 181    8.2852     9.8709     3.4639     4.9702     8.4639     7.0498 
   H 182    3.4640     4.9702    11.0446    10.8905    14.2654    13.1612 
   H 183    3.7951     4.0776    12.7694    12.2146    15.2072    14.2852 

              O  31      O  32      O  33      O  34      O  35      O  36
              ------------------------------------------------------------------
   O  31    0.0000 
   O  32    5.5549     0.0000 
   O  33    3.7320     2.0000     0.0000 
   O  34   13.5983     9.1278    10.9588     0.0000 
   O  35   11.6278     7.3850     9.1278     2.0000     0.0000 
   O  36    9.2504     3.7321     5.5550     7.6995     6.5904     0.0000 
   O  37    7.4641     2.2361     3.7321     9.1176     7.6995     2.0000 
   O  38   16.6609    11.6278    13.5983     3.7320     5.5549     9.1277 
   O  39   14.6613     9.6696    11.6279     2.2361     3.7321     7.3850 
   N  40   17.1374    14.5550    14.6485    20.4300    19.6810    13.1726 
   N  41   18.1180    12.8271    14.4002    12.4975    12.8934     9.1880 
   N  42   15.1982     9.8038    11.4665     9.9120    10.0417     6.1151 
   N  43   14.2477    12.2478    12.0530    19.1317    18.1249    11.5356 
   N  44   18.4372    14.4030    15.1975    17.8826    17.6217    11.8009 
   N  45   22.1588    16.6327    18.4462    13.2325    14.3505    12.9103 
   N  46   12.2134     8.8459     9.2186    14.8762    13.9734     7.4060 
   N  47   16.5676    11.0311    12.9814     7.1311     8.0564     7.5166 
   N  48    9.9209     8.8220     8.1584    16.9607    15.6083     9.3139 
   N  49   12.0084     6.4594     8.3996     6.1380     5.8075     2.9764 
   C  50   15.9985    13.0631    13.2981    18.7064    17.9818    11.5029 
   C  51   18.0661    12.6172    14.3349    11.1621    11.7520     8.8927 
   C  52   17.5715    12.1969    13.8418    11.5055    11.9344     8.5078 
   C  53   16.1820    13.5552    13.6556    19.5254    18.7402    12.2126 
   C  54   15.0703    12.0640    12.3181    17.7983    17.0352    10.5330 
   C  55   17.6035    12.1006    13.8823    10.1873    10.8304     8.3692 
   C  56   14.2893    11.5558    11.6734    17.7469    16.8791    10.3153 
   C  57   16.6059    11.1007    12.8863     9.5265    10.0403     7.3695 
   C  58   16.0665    10.6206    12.3355     9.9267    10.2532     6.9001 
   C  59   14.4945    12.1095    12.0792    18.6083    17.6850    11.1014 
   C  60   16.5720    11.2056    12.8426    10.9247    11.2222     7.5265 
   C  61   15.4572    13.1051    13.0771    19.4785    18.5985    12.0254 
   C  62   19.5994    14.1004    15.8759    11.6548    12.5011    10.3688 
   C  63   16.7026    13.2493    13.7356    18.0677    17.5153    11.2258 
   C  64   20.5976    15.1003    16.8733    12.4443    13.3705    11.3686 
   C  65   17.5472    13.9121    14.4960    18.2831    17.8348    11.6857 
   C  66   21.1634    15.6348    17.4528    12.3723    13.4331    11.9139 
   C  67   17.5500    13.6545    14.3700    17.5772    17.2114    11.2127 
   C  68   16.7083    12.7021    13.4683    16.6076    16.2200    10.2154 
   C  69   20.7699    15.2210    17.0831    11.5006    12.6347    11.5284 
   C  70   15.8189    11.9725    12.6463    16.3702    15.8680     9.6859 
   C  71   19.7803    14.2296    16.0987    10.6413    11.7109    10.5438 
   C  72   12.3665     9.7200     9.7576    16.4037    15.3959     8.8058 
   C  73   15.4106     9.8567    11.7467     7.6073     8.1193     6.1995 
   C  74   17.3952    15.0979    15.0737    21.2533    20.4497    13.9051 
   C  75   17.7097    12.5341    14.0168    12.9217    13.1742     8.9846 
   C  76   11.7616     8.8252     8.9786    15.4054    14.3972     7.8069 
   C  77   15.6078    10.0633    12.0042     6.8429     7.5417     6.5229 
   C  78   21.7008    16.1479    18.0251    12.0395    13.2786    12.4706 
   C  79   17.2817    13.0526    13.9435    16.3844    16.1160    10.3400 
   C  80   10.7662     7.9953     8.0409    14.9866    13.8763     7.3112 
   C  81   14.8941     9.3790    11.3488     5.8952     6.5426     5.9757 
   C  82   18.3340    13.2617    14.6711    13.9206    14.1553     9.7857 
   C  83   18.3693    16.0951    16.0723    22.1551    21.3855    14.8568 
   C  84   22.5946    17.1002    18.8688    14.1036    15.1575    13.3684 
   C  85   19.2812    15.3476    16.0955    18.8661    18.6191    12.7919 
   C  86   13.7057     8.1510    10.0633     6.6912     6.8429     4.5438 
   C  87   11.0760     9.1188     8.8252    16.5943    15.4054     8.8963 
   C  88   13.9269     8.3995    10.3625     5.8076     6.1465     4.9759 
   C  89   10.3963     8.1585     7.9556    15.6084    14.4075     7.9091 
   C  90   10.8557     9.4227     8.9173    17.2452    15.9796     9.5522 
   C  91   12.7658     7.2128     9.1025     6.8372     6.6932     3.5632 
   H  92   16.5781    13.6825    13.9071    19.2739    18.5715    12.1066 
   H  93   18.3934    12.9098    14.6665    10.9895    11.6805     9.1780 
   H  94   16.3255    13.8878    13.9088    20.0415    19.2215    12.6723 
   H  95   18.1913    12.8122    14.4613    11.8936    12.3959     9.1182 
   H  96   18.2221    12.7205    14.5002    10.6236    11.3369     8.9890 
   H  97   14.4997    11.4447    11.7122    17.2405    16.4516     9.9347 
   H  98   14.1961    11.2437    11.4586    17.2204    16.3903     9.8475 
   H  99   15.9876    10.4808    12.2691     9.1478     9.5702     6.7497 
   H 100   15.6434    10.1635    11.9172     9.3194     9.6332     6.4330 
   H 101   13.8747    11.5312    11.4715    18.1772    17.2122    10.6227 
   H 102   15.9984    10.6617    12.2718    10.7979    10.9883     7.0073 
   H 103   16.7107    11.4116    12.9901    11.4964    11.7435     7.7783 
   H 104   15.2037    13.0675    12.9455    19.6868    18.7515    12.1646 
   H 105   15.9680    13.7054    13.6476    20.0915    19.2174    12.6452 
   H 106   17.2586    13.8605    14.3261    18.6547    18.1203    11.8438 
   H 107   19.8839    14.4133    16.1544    12.2368    13.0455    10.6826 
   H 108   17.5742    14.1051    14.6080    18.7343    18.2383    12.0116 
   H 109   20.2637    14.7932    16.5341    12.5288    13.3691    11.0624 
   H 110   18.0799    14.2482    14.9354    18.1799    17.8265    11.8312 
   H 111   21.5300    15.9887    17.8308    12.3682    13.5090    12.2808 
   H 112   17.5935    14.8631    15.0264    20.4975    19.8052    13.3400 
   H 113   18.7361    13.4365    15.0173    12.8797    13.3450     9.7877 
   H 114   15.2180     9.8973    11.4928    10.4636    10.5278     6.2639 
   H 115   14.6609     9.2368    10.9291     9.3921     9.4636     5.5322 
   H 116   14.7117    12.8330    12.5982    19.7510    18.7444    12.1553 
   H 117   13.6581    11.7815    11.5252    18.8569    17.7998    11.2194 
   H 118   19.9857    14.4309    16.3258    10.4237    11.5827    10.7767 
   H 119   19.2377    13.6840    15.5675    10.0359    11.0921    10.0146 
   H 120   15.6382    11.6302    12.3872    15.7972    15.3283     9.2159 
   H 121   15.2052    11.4124    12.0515    16.0498    15.4859     9.2232 
   H 122   15.9931    10.4382    12.3397     7.7144     8.3693     6.7991 
   H 123   12.6011     9.6876     9.8519    16.0714    15.1236     8.5385 
   H 124   14.4207    11.0227    11.4525    16.4177    15.6979     9.2458 
   H 125   17.9416    12.3920    14.2590     9.3657    10.2322     8.7041 
   H 126   16.7795    14.5360    14.4816    20.8288    19.9870    13.4255 
   H 127   17.3690    15.2650    15.1607    21.6251    20.7773    14.2116 
   H 128   17.1909    11.9745    13.4873    12.3306    12.5613     8.3995 
   H 129   17.2960    12.1904    13.6210    13.0133    13.1717     8.7046 
   H 130   11.4145     8.2825     8.5189    14.7866    13.7782     7.1878 
   H 131   15.7607    10.2384    12.2022     6.4016     7.2301     6.7899 
   H 132   17.7848    13.6271    14.4828    16.9930    16.7343    10.9513 
   H 133   17.6563    13.3030    14.2654    16.2754    16.0824    10.4646 
   H 134   16.7864    12.4824    13.4113    15.7766    15.4977     9.7298 
   H 135   21.9299    16.3840    18.2370    12.5545    13.7473    12.6840 
   H 136   22.2811    16.7268    18.6123    12.4024    13.6994    13.0591 
   H 137   21.4872    15.9324    17.8323    11.5347    12.8228    12.2848 
   H 138   18.4828    14.3063    15.1768    17.4848    17.2801    11.5832 
   H 139   22.5230    16.9840    18.8207    13.2521    14.4431    13.2730 
   H 140   20.7543    15.3371    17.0225    13.4685    14.2535    11.6204 
   H 141   18.4745    15.0889    15.5601    19.6910    19.2198    13.0104 
   H 142   15.6727    11.4480    12.3235    15.2029    14.8042     8.8360 
   H 143   20.4687    14.9167    16.8351    10.4256    11.6973    11.3022 
   H 144   15.4109     9.9157    11.8946     5.8185     6.6511     6.5643 
   H 145   14.6510     9.1753    11.1618     5.2752     5.9539     5.9080 
   H 146   10.8295     7.7450     7.9402    14.4708    13.4048     6.8219 
   H 147   10.1664     7.4009     7.4212    14.5705    13.4098     6.8758 
   H 148   17.8626    12.8567    14.2191    13.9056    14.0526     9.4440 
   H 149   18.7374    13.7301    15.0957    14.5400    14.7648    10.2999 
   H 150   18.8141    13.6828    15.1350    13.9632    14.2842    10.1538 
   H 151   18.2427    16.1525    16.0528    22.4246    21.6072    15.0527 
   H 152   18.9745    16.7135    16.6915    22.7183    21.9684    15.4498 
   H 153   18.5159    16.0615    16.1158    21.8999    21.1796    14.6845 
   H 154   22.0439    16.5626    18.3155    13.8195    14.8100    12.8307 
   H 155   22.8825    17.4125    19.1524    14.6519    15.6690    13.6814 
   H 156   23.1489    17.6432    19.4262    14.4089    15.5221    13.9130 
   H 157   18.9635    15.1620    15.8405    18.9849    18.6731    12.7269 
   H 158   19.8118    15.9367    16.6582    19.4768    19.2376    13.4070 
   H 159   19.6135    15.5559    16.3702    18.7671    18.5856    12.8864 
   H 160    9.7881     7.7156     7.4177    15.4064    14.1446     7.7157 
   H 161   13.4939     7.9955     9.9759     5.2789     5.5389     4.7057 
   H 162   11.9056     8.3419     8.8067    14.2563    13.3579     6.7960 
   H 163   12.8332     9.4089     9.8235    15.1927    14.3531     7.8179 
   H 164   16.7302    11.2188    13.1883     6.7549     7.8052     7.7894 
   H 165   17.0177    11.4698    13.4025     7.7434     8.6749     7.8970 
   H 166   12.3027     6.7616     8.6150     7.1899     6.8860     3.0602 
   H 167   13.0935     7.5559     9.3996     7.4136     7.3105     3.8456 
   H 168   10.9787     9.8376     9.2292    17.7944    16.5004    10.1099 
   H 169   11.4758     9.9613     9.5074    17.6347    16.4124     9.9353 
   H 170    9.8516     9.1075     8.3185    17.4053    16.0131     9.7916 
   H 171    9.4414     8.2040     7.5681    16.3629    14.9979     8.7308 
   H 172   11.4194     5.8661     7.7950     6.3658     5.8391     2.3567 
   H 173   12.1555     6.6361     8.6086     5.5309     5.2805     3.3427 
   H 174   11.9194     7.1883     9.0720     2.0194     1.3894     5.7169 
   H 175   13.4184     9.3911    11.0959     1.3895     2.0195     8.4877 
   H 176    4.8725     2.0194     1.3895    11.0958     9.3910     4.8013 
   H 177    4.8013     1.3894     2.0195     9.0719     7.1882     4.8725 
   H 178    1.3894     4.8013     2.8242    13.4184    11.4978     8.3597 
   H 179    2.0195     4.8725     3.6001    11.9195     9.9255     8.5679 
   H 180    8.3596     2.8242     4.8013     7.0982     5.7168     1.3895 
   H 181    8.5678     3.6000     4.8725     9.6973     8.4876     2.0194 
   H 182   15.1560     9.9255    11.9195     3.6000     4.8725     7.1883 
   H 183   16.2741    11.4979    13.4185     2.8242     4.8013     9.3911 

              O  37      O  38      O  39      N  40      N  41      N  42
              ------------------------------------------------------------------
   O  37    0.0000 
   O  38   10.9587     0.0000 
   O  39    9.1278     2.0000     0.0000 
   N  40   12.7797    20.4211    19.3403     0.0000 
   N  41   10.6921    10.6788    10.5433    11.7697     0.0000 
   N  42    7.7351     8.8028     8.1944    11.9028     3.1195     0.0000 
   N  43   10.7429    19.6736    18.3470     3.1195    12.4432    11.7695 
   N  44   12.2413    17.0166    16.3516     5.2915     7.0719     8.2193 
   N  45   14.7432    10.1535    11.0001    16.8237     5.2915     7.2197 
   N  46    6.9751    15.3579    14.0318     5.8186     9.0350     7.7367 
   N  47    9.5080     4.8610     4.9753    16.2213     5.8186     4.3199 
   N  48    7.9090    18.2907    16.6606     7.4689    13.5315    11.8407 
   N  49    4.9760     6.5401     5.0889    14.3359     7.4689     4.4119 
   C  50   11.2064    18.6966    17.6083     1.7320    10.2792    10.2248 
   C  51   10.6041     9.0797     9.1120    13.3187     1.7320     2.9093 
   C  52   10.1136     9.6932     9.5437    12.3231     1.0000     2.3941 
   C  53   11.7878    19.6115    18.4834     1.0000    11.2779    11.1957 
   C  54   10.2083    17.8927    16.7522     2.6458     9.8654     9.5504 
   C  55   10.1690     8.0847     8.1210    13.9184     2.6457     2.7321 
   C  56    9.8086    18.0494    16.8169     3.0000    10.5130     9.9335 
   C  57    9.1767     7.7331     7.5448    13.5840     2.9999     1.9319 
   C  58    8.6052     8.4450     8.0608    12.6094     2.6457     1.0000 
   C  59   10.4680    18.9955    17.7311     2.6457    11.4915    10.9304 
   C  60    9.1152     9.4019     9.0585    11.9441     1.7320     1.4142 
   C  61   11.4433    19.7546    18.5420     1.7320    11.8485    11.5242 
   C  62   12.1575     9.0823     9.4870    14.7687     2.9999     4.5747 
   C  63   11.2345    17.7448    16.8017     3.0000     8.7712     9.0710 
   C  64   13.1531     9.6979    10.2484    15.2745     3.6055     5.5372 
   C  65   11.8413    17.7551    16.9153     3.6056     8.3509     8.9899 
   C  66   13.7537     9.4091    10.1477    16.2740     4.5826     6.2764 
   C  67   11.5260    16.9174    16.1414     4.5826     7.3626     8.1253 
   C  68   10.5583    16.0246    15.2030     5.0000     6.7731     7.2586 
   C  69   13.4212     8.4530     9.2680    16.7683     5.0000     6.1962 
   C  70    9.8730    16.0131    15.0765     4.5826     7.2850     7.3588 
   C  71   12.4471     7.7389     8.4184    16.3089     4.5826     5.3536 
   C  72    8.0836    17.0325    15.6567     4.8915    10.6048     9.4561 
   C  73    8.1446     6.0921     5.6778    14.5754     4.8916     2.7321 
   C  74   13.4049    21.3323    20.2146     1.0000    12.7693    12.8637 
   C  75   10.3518    11.3381    11.0550    10.7701     1.0000     3.1621 
   C  76    7.1239    16.0733    14.6758     5.7320    10.0341     8.6704 
   C  77    8.5118     5.1056     4.8157    15.5590     5.7320     3.7322 
   C  78   14.3784     8.8133     9.8040    17.6319     5.8873     7.1962 
   C  79   10.8646    15.5872    14.8763     5.8873     5.9570     6.7846 
   C  80    6.4231    15.8773    14.3914     6.6170    10.5335     8.9023 
   C  81    7.9756     4.5233     3.9476    15.9268     6.6169     4.3198 
   C  82   11.0543    12.3140    12.0538    10.2791     1.7321     4.1230 
   C  83   14.3897    22.1469    21.0724     1.7321    13.3188    13.5945 
   C  84   15.1460    11.0984    11.8778    16.4226     5.1961     7.4916 
   C  85   13.1993    17.9437    17.3144     5.1962     7.8324     9.1591 
   C  86    6.5229     6.0781     5.1056    14.3521     6.0710     3.2350 
   C  87    7.8069    17.5877    16.0733     6.0709    12.0324    10.5740 
   C  88    6.9757     5.0890     4.1257    15.3497     6.7664     4.1145 
   C  89    6.8085    16.6607    15.1196     6.7664    11.5328     9.8777 
   C  90    8.3094    18.3797    16.8178     6.4697    13.0319    11.5381 
   C  91    5.5315     6.7365     5.5231    13.8178     6.4697     3.4253 
   H  92   11.8252    19.2042    18.1464     1.2347    10.5751    10.6685 
   H  93   10.9431     8.7353     8.8904    13.9364     2.2901     3.3410 
   H  94   12.1755    20.1827    19.0321     0.8743    11.8972    11.8001 
   H  95   10.7328     9.9202     9.8834    12.5923     0.8743     3.0083 
   H  96   10.7850     8.3556     8.5177    14.1572     2.6008     3.2837 
   H  97    9.5899    17.4045    16.2298     3.2380     9.6522     9.1624 
   H  98    9.4300    17.4659    16.2552     3.3533     9.9085     9.3159 
   H  99    8.5623     7.5734     7.2341    13.4100     3.3532     1.5565 
   H 100    8.1963     7.9311     7.4780    12.9159     3.2644     1.0313 
   H 101    9.9267    18.6614    17.3541     3.2644    11.4692    10.7410 
   H 102    8.5498     9.4863     9.0115    11.5549     2.1829     0.9735 
   H 103    9.2786    10.0205     9.6551    11.4118     1.4155     1.7679 
   H 104   11.4836    20.0686    18.8114     2.1829    12.3720    11.9444 
   H 105   12.0579    20.3395    19.1418     1.4155    12.2813    12.0570 
   H 106   11.8520    18.2790    17.3649     2.7430     9.1163     9.5684 
   H 107   12.4263     9.6995    10.0795    14.4566     2.7430     4.7490 
   H 108   12.0744    18.2828    17.4067     3.0074     8.9651     9.5393 
   H 109   12.8058     9.9234    10.3589    14.6549     3.0074     5.1235 
   H 110   12.1285    17.4768    16.7267     4.4187     7.7704     8.6771 
   H 111   14.1488     9.2799    10.1345    16.8936     5.1927     6.7684 
   H 112   13.0349    20.3753    19.3475     0.6200    11.4877    11.7760 
   H 113   11.3070    10.9137    10.8803    12.0769     0.6200     3.6973 
   H 114    7.7739     9.4196     8.7834    11.3003     2.9306     0.6199 
   H 115    7.1975     8.4535     7.7383    12.0960     3.7360     0.6200 
   H 116   11.3512    20.2763    18.9592     2.9306    12.9047    12.3185 
   H 117   10.3428    19.5094    18.1366     3.7360    12.5958    11.7686 
   H 118   12.7079     7.3827     8.1901    16.9063     5.1957     5.8111 
   H 119   11.9355     7.1918     7.8171    16.2580     4.6339     5.0271 
   H 120    9.4966    15.4008    14.4797     5.1957     6.7244     6.7388 
   H 121    9.3345    15.8235    14.8213     4.6339     7.4616     7.2728 
   H 122    8.7527     5.8946     5.6877    14.9879     4.8674     3.0891 
   H 123    7.9491    16.5925    15.2583     4.8674     9.9898     8.8919 
   H 124    9.0674    16.4770    15.3442     4.0130     8.6750     8.1714 
   H 125   10.6109     6.9196     7.2064    15.2972     4.0130     3.7684 
   H 126   12.8738    20.9941    19.8359     1.0812    12.6606    12.6097 
   H 127   13.6332    21.7843    20.6319     1.5968    13.3482    13.3736 
   H 128    9.8051    10.8246    10.4873    10.9133     1.0812     2.5425 
   H 129    9.9883    11.5963    11.2112    10.1968     1.5968     3.1319 
   H 130    6.5351    15.4813    14.0690     6.2766     9.7152     8.2067 
   H 131    8.7889     4.4970     4.3112    16.1697     6.2766     4.3522 
   H 132   11.4479    16.1542    15.4695     5.6520     6.3574     7.3527 
   H 133   11.0956    15.3425    14.7043     6.4540     5.4817     6.5504 
   H 134   10.2856    15.0242    14.2854     6.1762     5.5966     6.2263 
   H 135   14.5639     9.3823    10.3185    17.3356     5.6520     7.2228 
   H 136   14.9748     9.0850    10.1716    18.1744     6.4540     7.8162 
   H 137   14.2176     8.2517     9.3024    17.9448     6.1761     7.2228 
   H 138   12.1205    16.5282    15.9103     5.8808     6.4814     7.7464 
   H 139   15.1330    10.0647    11.0161    17.4416     5.8808     7.6917 
   H 140   13.2908    10.9166    11.3139    14.2146     2.9435     5.5561 
   H 141   13.0683    19.1649    18.3310     2.9435     9.6086    10.3900 
   H 142    9.2714    14.7007    13.8281     5.9720     5.9519     5.9944 
   H 143   13.2561     7.2036     8.1912    17.6905     5.9720     6.5385 
   H 144    8.5628     4.0727     3.7471    16.4487     6.8106     4.7303 
   H 145    7.8978     4.0631     3.3469    16.3581     7.2342     4.8740 
   H 146    6.0557    15.2944    13.8302     6.8106     9.9628     8.2867 
   H 147    5.8863    15.5809    14.0485     7.2342    10.6833     8.8867 
   H 148   10.6371    12.4589    12.0997     9.7308     2.1115     4.0179 
   H 149   11.5120    12.9208    12.6730    10.0129     2.2901     4.7269 
   H 150   11.4899    12.1989    12.0396    10.8352     1.5201     4.3155 
   H 151   14.5066    22.5056    21.3912     2.1115    13.8304    14.0137 
   H 152   15.0012    22.6593    21.6103     2.2901    13.6851    14.0641 
   H 153   14.2987    21.7998    20.7671     1.5201    12.8168    13.1910 
   H 154   14.5888    10.9200    11.6050    15.8497     4.5761     6.9103 
   H 155   15.4230    11.6888    12.4312    16.2000     5.2330     7.7207 
   H 156   15.7079    11.3080    12.1762    16.9989     5.8162     8.0788 
   H 157   13.0416    18.1791    17.4874     4.5762     8.2291     9.3780 
   H 158   13.7962    18.5224    17.9134     5.2330     8.3294     9.7479 
   H 159   13.3839    17.7269    17.1620     5.8162     7.4661     8.9778 
   H 160    6.4880    16.5927    15.0035     7.3609    11.8742    10.0856 
   H 161    6.6937     4.9036     3.7322    15.6340     7.3610     4.6354 
   H 162    6.4210    14.7581    13.4190     6.4044     8.7152     7.2562 
   H 163    7.4942    15.5362    14.2702     5.3577     8.7686     7.6782 
   H 164    9.7886     4.2901     4.5573    16.8264     6.4044     4.9289 
   H 165    9.8745     5.3601     5.5762    16.0491     5.3577     4.1656 
   H 166    4.9936     7.3009     6.0081    13.3448     6.5806     3.4738 
   H 167    5.7551     7.1148     6.0146    13.3528     5.8818     2.8153 
   H 168    8.8137    18.9745    17.3991     6.5806    13.6226    12.1556 
   H 169    8.7717    18.6662    17.1430     5.8817    12.9592    11.6057 
   H 170    8.3185    18.8105    17.1575     7.7787    14.1512    12.4516 
   H 171    7.2985    17.7377    16.0902     7.8156    13.2500    11.4515 
   H 172    4.3561     7.0447     5.5021    14.0646     7.7787     4.6771 
   H 173    5.3212     5.9740     4.4781    14.9551     7.8156     4.8205 
   H 174    7.0982     4.8013     2.8243    18.6184    11.5072     8.6769 
   H 175    9.6973     4.8725     3.6002    21.4499    13.8572    11.2163 
   H 176    2.8242    13.4183    11.4978    13.2976    13.2847    10.4345 
   H 177    3.6001    11.9194     9.9255    15.8622    14.0507    10.9875 
   H 178    6.4714    16.2741    14.2851    15.7498    17.0147    14.1599 
   H 179    7.0498    15.1559    13.1612    18.0465    17.6996    14.6692 
   H 180    2.0195     9.0719     7.1882    14.3318    10.4608     7.3568 
   H 181    1.3894    11.0958     9.3911    11.5522     9.5564     6.7166 
   H 182    9.0720     2.0194     1.3894    18.4725     9.2314     7.0345 
   H 183   11.0959     1.3894     2.0195    21.2567    11.9159     9.8572 

              N  43      N  44      N  45      N  46      N  47      N  48
              ------------------------------------------------------------------
   N  43    0.0000 
   N  44    7.2196     0.0000 
   N  45   17.7127    11.7697     0.0000 
   N  46    4.3198     6.3245    14.2929     0.0000 
   N  47   15.9535    12.3596     6.3245    11.7697     0.0000 
   N  48    4.4119    10.3422    18.7294     4.5826    15.4618     0.0000 
   N  49   13.2581    11.8398    10.3422     8.9434     4.5826    11.7697 
   C  50    2.9092     4.3589    15.4329     4.2342    14.5375     6.7121 
   C  51   13.7633     8.7679     4.3589    10.0781     4.2342    14.4303 
   C  52   12.7737     7.8324     5.1962     9.1379     4.8366    13.5366 
   C  53    2.3940     5.1962    16.4227     4.8366    15.5027     6.6021 
   C  54    2.7320     4.5826    15.0944     3.2348    13.8398     5.9880 
   C  55   14.1691     9.5503     4.5826    10.3168     3.2348    14.5386 
   C  56    1.9318     5.5678    15.7809     2.9093    14.1681     5.0195 
   C  57   13.6321     9.4875     5.5678     9.6561     2.9094    13.7664 
   C  58   12.6322     8.6304     6.2450     8.6704     3.7321    12.8265 
   C  59    0.9999     6.2450    16.7502     3.7321    15.1569     4.8716 
   C  60   12.1754     7.7556     6.0828     8.3848     4.6252    12.7036 
   C  61    1.4141     6.0828    17.0558     4.6252    15.7965     5.7383 
   C  62   15.3824     9.9800     2.6458    11.7826     4.5237    16.1581 
   C  63    4.5746     2.6457    13.8365     4.5236    13.3846     7.9484 
   C  64   16.0483    10.3343     1.7321    12.5708     5.3351    16.9982 
   C  65    5.5371     1.7320    13.2760     5.3351    13.2646     8.9351 
   C  66   17.0238    11.3282     1.0000    13.4941     5.3851    17.8867 
   C  67    6.2762     1.0000    12.2769     5.3851    12.3676     9.3435 
   C  68    6.1961     1.7320    11.8485     4.6406    11.5395     8.8377 
   C  69   17.3535    11.9441     1.7320    13.6734     4.6406    17.9742 
   C  70    5.3534     2.6457    12.4733     3.6790    11.6772     7.8386 
   C  71   16.7397    11.6390     2.6457    12.9524     3.6790    17.1818 
   C  72    2.7320     6.8842    15.8883     1.7322    13.5013     3.4641 
   C  73   14.2322    10.9268     6.8843    10.0383     1.7322    13.7589 
   C  74    3.1621     6.2450    17.8204     6.5054    17.1792     7.5710 
   C  75   11.4705     6.1223     6.2450     8.1588     6.5054    12.6928 
   C  76    3.7321     7.0279    15.2883     1.0001    12.6323     3.6055 
   C  77   15.1569    11.9207     7.0279    10.9305     1.0001    14.5264 
   C  78   18.2917    12.7271     1.5060    14.6516     5.4032    18.9679 
   C  79    7.1961     1.5059    10.9364     5.4033    10.9896     9.7348 
   C  80    4.3198     7.9866    15.7311     1.7322    12.6854     2.9999 
   C  81   15.3335    12.5360     7.9865    11.0512     1.7322    14.4107 
   C  82   11.2355     5.3988     6.5575     8.2277     7.4689    12.8050 
   C  83    4.1230     6.5575    18.2730     7.4689    17.9144     8.5157 
   C  84   17.4758    11.2779     1.0001    14.2273     7.1037    18.7257 
   C  85    7.4915     1.0000    12.3231     7.1037    13.2498    10.9159 
   C  86   13.6443    11.2601     8.6126     9.3476     3.0001    12.6853 
   C  87    3.2349     8.6125    17.2804     3.0000    14.4109     1.7321 
   C  88   14.6060    12.2268     8.7279    10.2996     2.6459    13.5137 
   C  89    4.1144     8.7279    16.7305     2.6459    13.6004     1.9999 
   C  90    3.4253     9.4641    18.2772     4.0001    15.3207     1.0000 
   C  91   12.9378    11.0514     9.4641     8.6214     4.0001    11.7842 
   H  92    3.1761     4.3318    15.6712     4.8539    14.9873     7.1943 
   H  93   14.3777     9.3547     3.8787    10.6665     3.9426    14.9911 
   H  94    2.2454     5.7415    17.0369     5.2711    16.1032     6.6094 
   H  95   13.1692     7.9430     4.6695     9.6274     5.0632    14.0639 
   H  96   14.5266     9.6413     3.9755    10.7528     3.5649    15.0308 
   H  97    2.8015     4.8212    14.9144     2.6154    13.4265     5.5820 
   H  98    2.5358     5.2004    15.1820     2.4659    13.5560     5.2065 
   H  99   13.3261     9.5013     6.1810     9.2770     2.8686    13.3029 
   H 100   12.7987     9.0983     6.5671     8.7439     3.3228    12.7797 
   H 101    1.0312     6.5671    16.7489     3.3228    14.9223     4.2852 
   H 102   11.6737     7.5585     6.7003     7.8195     4.8108    12.1054 
   H 103   11.7443     7.1474     6.2748     8.0607     5.2440    12.4561 
   H 104    0.9735     6.7003    17.5985     4.8108    16.1924     5.3850 
   H 105    1.7678     6.2748    17.4560     5.2440    16.3424     6.1755 
   H 106    4.7488     2.6009    14.1018     5.1084    13.8718     8.3596 
   H 107   15.1854     9.5770     2.6009    11.6968     5.1084    16.1289 
   H 108    5.1234     2.2901    13.8955     5.3977    13.8280     8.7300 
   H 109   15.4450     9.7187     2.2901    12.0045     5.3977    16.4538 
   H 110    6.4043     0.8743    12.5751     5.8848    12.8932     9.6957 
   H 111   17.6300    11.9449     0.8743    14.0718     5.5078    18.4433 
   H 112    3.6972     4.8399    16.4779     6.0597    16.0951     8.0011 
   H 113   12.8730     7.2373     4.8399     9.5623     6.0597    14.0811 
   H 114   11.2281     7.6074     7.4348     7.2562     4.9288    11.4515 
   H 115   11.8032     8.6220     7.6484     7.6783     4.1655    11.6439 
   H 116    0.6200     7.4348    18.1585     4.9288    16.5222     4.8204 
   H 117    0.6201     7.6484    17.8803     4.1655    15.8996     3.7994 
   H 118   17.2966    12.2564     2.8113    13.4673     3.6454    17.6517 
   H 119   16.5740    11.7047     3.2657    12.7067     3.0595    16.8671 
   H 120    5.8110     2.8113    11.9431     3.6454    11.0571     7.9977 
   H 121    5.0270     3.2657    12.7035     3.0595    11.5893     7.2705 
   H 122   14.7331    11.1869     6.3807    10.5699     1.2348    14.3472 
   H 123    3.0890     6.3807    15.2752     1.2348    12.9761     4.0130 
   H 124    3.7683     4.3433    13.9473     2.2353    12.4457     6.0202 
   H 125   15.4492    10.9659     4.3433    11.4955     2.2353    15.5864 
   H 126    2.5425     6.3409    17.7719     6.0195    16.9146     6.9511 
   H 127    3.1319     6.8637    18.4187     6.8063    17.6834     7.4845 
   H 128   11.4443     6.4517     6.3409     7.9634     6.0195    12.4515 
   H 129   10.8541     5.6588     6.8637     7.5499     6.8063    12.0927 
   H 130    4.3521     7.1858    14.9378     0.8744    12.1038     3.8242 
   H 131   15.7347    12.5374     7.1858    11.4925     0.8744    15.0159 
   H 132    7.2228     0.8901    11.2150     5.7955    11.5243    10.0116 
   H 133    7.8161     1.6788    10.3791     5.9118    10.6814    10.3005 
   H 134    7.2228     2.1242    10.6865     5.0569    10.4642     9.4905 
   H 135   18.0921    12.3636     0.8902    14.5401     5.7954    18.9103 
   H 136   18.8766    13.2273     1.6788    15.2596     5.9118    19.5844 
   H 137   18.5099    13.1099     2.1242    14.7883     5.0568    19.0455 
   H 138    7.6916     0.6200    11.1500     6.4773    11.8376    10.6402 
   H 139   18.3130    12.3894     0.6200    14.8604     6.4773    19.2777 
   H 140   15.1933     9.1510     2.6200    11.9524     6.3419    16.4685 
   H 141    5.5560     2.6200    14.3889     6.3419    14.6503     9.4355 
   H 142    6.5384     2.9806    11.1874     3.9669    10.3076     8.4609 
   H 143   18.0726    13.0254     2.9806    14.2224     3.9669    18.3757 
   H 144   15.9100    12.9449     7.7399    11.6375     1.4157    15.0282 
   H 145   15.6712    13.0756     8.4989    11.3696     2.1830    14.5871 
   H 146    4.7302     7.7399    15.1424     1.4156    12.0676     3.5888 
   H 147    4.8739     8.4989    15.8286     2.1830    12.5425     2.9560 
   H 148   10.6278     4.9617     7.1345     7.6134     7.6474    12.1925 
   H 149   11.1326     4.9985     6.8180     8.3307     8.0707    12.9131 
   H 150   11.8444     5.8690     5.9890     8.8428     7.3386    13.4182 
   H 151    4.0180     7.1345    18.8211     7.6474    18.3318     8.3448 
   H 152    4.7269     6.8180    18.5751     8.0707    18.3827     9.1073 
   H 153    4.3156     5.9889    17.7296     7.3386    17.5090     8.7274 
   H 154   16.8701    10.7305     1.1767    13.6077     6.7561    18.1059 
   H 155   17.3563    11.0076     1.6200    14.2219     7.6128    18.7502 
   H 156   18.0825    11.8324     1.1767    14.8471     7.4868    19.3456 
   H 157    6.9102     1.1766    12.8325     6.7561    13.5340    10.4288 
   H 158    7.7205     1.6200    12.6938     7.6128    13.8094    11.3015 
   H 159    8.0787     1.1766    11.8242     7.4867    12.9890    11.4160 
   H 160    4.6354     9.3126    17.0309     3.1409    13.6904     1.7732 
   H 161   14.7750    12.6668     9.3127    10.4572     3.1410    13.4971 
   H 162    4.9288     6.5470    13.9397     0.6200    11.2282     4.8213 
   H 163    4.1655     5.7184    14.0498     0.6200    11.8033     5.0105 
   H 164   16.5222    12.9793     6.5470    12.3186     0.6200    15.9421 
   H 165   15.8995    12.0439     5.7184    11.7687     0.6200    15.5809 
   H 166   12.3865    10.7593     9.8740     8.0670     4.5876    11.1687 
   H 167   12.5780    10.4690     9.0780     8.2751     3.9401    11.6208 
   H 168    3.4738     9.8740    18.8754     4.5876    15.9395     1.0813 
   H 169    2.8153     9.0779    18.2282     3.9400    15.4797     1.5968 
   H 170    4.6771    10.8687    19.3491     5.1928    16.0456     0.6200 
   H 171    4.8205    10.3906    18.4108     4.4187    14.9918     0.6200 
   H 172   12.8746    11.7864    10.8687     8.5743     5.1928    11.2463 
   H 173   13.8703    12.4106    10.3906     9.5576     4.4187    12.3186 
   H 174   17.2074    16.3596    13.0354    12.9866     6.7210    14.9483 
   H 175   20.0114    19.0968    14.5989    15.8089     8.5203    17.6025 
   H 176   10.7611    13.8209    17.5268     7.8307    12.3177     7.0239 
   H 177   13.4719    15.7924    17.6558    10.1941    11.8525     9.8520 
   H 178   12.8701    17.0911    21.2146    10.8455    15.8056     8.5626 
   H 179   15.3026    18.7970    21.3878    12.7695    15.5373    11.1302 
   H 180   12.5169    13.1657    13.9239     8.5228     8.2107     9.9046 
   H 181    9.6860    10.8530    13.8627     5.7336     9.0275     7.2945 
   H 182   17.6656    15.2436     9.6367    13.3479     3.5920    16.2877 
   H 183   20.3371    18.0716    11.5429    16.0187     6.1229    18.6775 

              N  49      C  50      C  51      C  52      C  53      C  54
              ------------------------------------------------------------------
   N  49    0.0000 
   C  50   12.6065     0.0000 
   C  51    6.7121    11.7697     0.0000 
   C  52    6.6021    10.7701     1.0000     0.0000 
   C  53   13.4532     1.0000    12.7693    11.7697     0.0000 
   C  54   11.7214     1.0001    11.2779    10.2791     1.7321     0.0000 
   C  55    5.9880    12.3231     1.0000     1.7320    13.3187    11.7696 
   C  56   11.7442     1.7321    11.8485    10.8562     2.0000     1.0000 
   C  57    5.0196    11.9441     1.7320     2.0000    12.9303    11.3282 
   C  58    4.8716    10.9605     2.0000     1.7320    11.9441    10.3343 
   C  59   12.6489     2.0000    12.8420    11.8485     1.7320     1.7321 
   C  60    5.7383    10.3344     1.7320     1.0000    11.3282     9.7706 
   C  61   13.4731     1.7320    13.2760    12.2769     1.0000     2.0000 
   C  62    7.9484    13.2760     1.7320     2.6457    14.2752    12.8420 
   C  63   11.9298     1.7321    10.3343     9.3417     2.6458     2.0000 
   C  64    8.9351    13.8365     2.6457     3.4641    14.8316    13.4578 
   C  65   12.1566     2.6458     9.9800     9.0040     3.4641     3.0000 
   C  66    9.3435    14.8317     3.4641     4.3589    15.8275    14.4445 
   C  67   11.4768     3.4641     9.0040     8.0338     4.3589     3.6055 
   C  68   10.4970     3.6056     8.3509     7.3626     4.5826     3.4641 
   C  69    8.8377    15.2746     3.6056     4.5826    16.2740    14.8316 
   C  70   10.2335     3.0000     8.7712     7.7720     4.0000     2.6457 
   C  71    7.8386    14.7688     3.0000     4.0000    15.7685    14.2752 
   C  72   10.5708     3.6326    11.7300    10.7733     3.8981     2.7320 
   C  73    3.4640    12.8782     3.6327     3.8982    13.8339    12.1565 
   C  74   15.1850     2.6457    14.3150    13.3187     1.7320     3.4641 
   C  75    7.5710     9.2807     2.6457     1.7320    10.2792     8.8768 
   C  76    9.5935     4.3198    11.0612    10.1268     4.7321     3.3460 
   C  77    3.6055    13.8572     4.3198     4.7321    14.8082    13.1233 
   C  78    9.7347    16.1645     4.5747     5.5372    17.1625    15.7466 
   C  79   10.3344     4.5748     7.5906     6.6196     5.5372     4.4641 
   C  80    9.3476     5.2780    11.4407    10.5400     5.6204     4.3198 
   C  81    2.9999    14.2082     5.2779     5.6203    15.1372    13.4291 
   C  82    8.5157     8.8768     3.4641     2.6458     9.8654     8.5710 
   C  83   16.0660     3.4641    14.9082    13.9185     2.6458     4.3590 
   C  84   10.9159    15.0944     4.5826     5.2915    16.0739    14.8157 
   C  85   12.8340     4.5826     9.5503     8.6417     5.2915     5.0000 
   C  86    1.7320    12.6249     5.1112     5.1374    13.5346    11.8147 
   C  87   11.0514     5.1112    13.0350    12.1099     5.1373     4.3197 
   C  88    1.9999    13.6219     5.6204     5.7955    14.5287    12.8071 
   C  89   10.1207     5.6204    12.4367    11.5387     5.7955     4.7320 
   C  90   11.8399     5.7321    14.0248    13.1034     5.6029     5.0391 
   C  91    1.0000    12.0859     5.7321     5.6029    12.9667    11.2370 
   H  92   13.1634     0.6200    12.1060    11.1088     0.8743     1.6200 
   H  93    6.8530    12.3895     0.6201     1.6200    13.3892    11.8972 
   H  94   13.9883     1.6199    13.3891    12.3894     0.6200     2.2901 
   H  95    7.1556    11.0771     0.8743     0.6200    12.0769    10.6295 
   H  96    6.5932    12.5923     0.8743     1.8396    13.5910    12.0768 
   H  97   11.1825     1.6200    11.0076    10.0129     2.2901     0.6200 
   H  98   11.1916     1.8397    11.2331    10.2417     2.3716     0.8743 
   H  99    4.4262    11.7459     2.2901     2.3715    12.7230    11.0910 
   H 100    4.2852    11.2446     2.4775     2.3364    12.2185    10.5786 
   H 101   12.2661     2.4775    12.7627    11.7762     2.3364     1.9850 
   H 102    5.3850     9.9190     2.3451     1.5967    10.9072     9.3186 
   H 103    6.1755     9.8225     2.0295     1.0812    10.8195     9.2904 
   H 104   13.7298     2.3451    13.7718    12.7743     1.5967     2.5068 
   H 105   14.0773     2.0295    13.7407    12.7408     1.0812     2.5069 
   H 106   12.5169     1.8397    10.7159     9.7304     2.6008     2.3716 
   H 107    8.3596    12.9996     1.8397     2.6008    13.9964    12.6053 
   H 108   12.5996     2.2146    10.5875     9.6086     2.9435     2.7431 
   H 109    8.7300    13.2198     2.2146     2.9435    14.2146    12.8471 
   H 110   12.0859     3.5192     9.4394     8.4825     4.3318     3.8242 
   H 111    9.6402    15.4490     4.0130     4.9340    16.4451    15.0571 
   H 112   14.3809     1.8396    13.0702    12.0798     1.4158     2.8292 
   H 113    8.0011    10.6296     1.8396     1.4158    11.6249    10.2603 
   H 114    4.8204     9.6288     3.0771     2.3796    10.6037     8.9696 
   H 115    3.7994    10.3975     3.4082     2.9806    11.3536     9.6798 
   H 116   13.8703     3.0771    14.2574    13.2641     2.3796     3.0891 
   H 117   13.0514     3.4082    13.8627    12.8807     2.9806     3.0890 
   H 118    7.9977    15.3573     3.5889     4.5875    16.3567    14.8513 
   H 119    7.2705    14.6876     2.9562     3.9400    15.6856    14.1576 
   H 120    9.6640     3.5889     8.1833     7.1834     4.5875     3.1512 
   H 121    9.9132     2.9562     8.8772     7.8778     3.9400     2.4059 
   H 122    4.0130    13.3030     3.4477     3.8678    14.2679    12.6056 
   H 123   10.1694     3.4477    11.1290    10.1685     3.8678     2.4808 
   H 124   10.3248     2.2901    10.0129     9.0193     3.1408     1.4157 
   H 125    6.0202    13.6851     2.2901     3.1408    14.6776    13.1036 
   H 126   14.7867     2.4059    14.1694    13.1703     1.4155     3.1022 
   H 127   15.5837     3.1512    14.8801    13.8825     2.1829     3.8918 
   H 128    6.9511     9.3731     2.4059     1.4155    10.3731     8.9081 
   H 129    7.4845     8.6886     3.1512     2.1829     9.6880     8.2688 
   H 130    8.9900     4.8013    10.6726     9.7560     5.2781     3.8097 
   H 131    3.8242    14.4655     4.8013     5.2781    15.4139    13.7251 
   H 132   10.9504     4.4803     8.0254     7.0704     5.4024     4.5070 
   H 133   10.2812     5.1816     7.1489     6.1954     6.1363     5.0841 
   H 134    9.7187     4.7491     7.1828     6.1980     5.7364     4.5070 
   H 135   10.0115    15.8993     4.4803     5.4023    16.8947    15.5143 
   H 136   10.3005    16.7225     5.1816     6.1363    17.7194    16.3189 
   H 137    9.4904    16.4487     4.7489     5.7362    17.4483    15.9995 
   H 138   11.4824     4.8708     8.1861     7.2610     5.7415     5.0104 
   H 139   10.6402    16.0464     4.8708     5.7415    17.0369    15.7013 
   H 140    9.4355    12.8472     2.7431     3.2069    13.8326    12.5433 
   H 141   13.5610     2.7431    11.2716    10.3092     3.2069     3.4849 
   H 142    9.0860     4.3734     7.3994     6.3995     5.3720     3.9142 
   H 143    8.4609    16.1417     4.3734     5.3720    17.1410    15.6337 
   H 144    3.5888    14.7351     5.3677     5.8107    15.6719    13.9703 
   H 145    2.9560    14.6339     5.8958     6.2383    15.5511    13.8346 
   H 146    8.7728     5.3676    10.8420     9.9484     5.8107     4.3807 
   H 147    9.0413     5.8958    11.5075    10.6324     6.2383     4.9338 
   H 148    8.3448     8.3005     3.8121     2.9083     9.2927     7.9727 
   H 149    9.1073     8.6750     4.0130     3.2380     9.6522     8.4356 
   H 150    8.7274     9.4585     3.1995     2.5121    10.4435     9.1722 
   H 151   16.3605     3.8121    15.4018    14.4088     2.9083     4.6403 
   H 152   16.6189     4.0130    15.2972    14.3127     3.2380     4.9340 
   H 153   15.7904     3.1995    14.4243    13.4389     2.5121     4.1518 
   H 154   10.4288    14.5060     4.0019     4.6842    15.4881    14.2158 
   H 155   11.3015    14.9144     4.8212     5.4428    15.8855    14.6746 
   H 156   11.4161    15.6852     5.1725     5.9015    16.6622    15.4172 
   H 157   12.9129     4.0019     9.9325     9.0028     4.6842     4.4739 
   H 158   13.4509     4.8212    10.0549     9.1625     5.4428     5.3371 
   H 159   12.7847     5.1725     9.1941     8.3112     5.9016     5.5457 
   H 160   10.0581     6.2381    12.7118    11.8347     6.3964     5.3520 
   H 161    1.7731    13.9028     6.2382     6.3965    14.7925    13.0645 
   H 162    8.3302     4.7896     9.6820     8.7607     5.4294     3.7950 
   H 163    9.1922     3.7217     9.8943     8.9349     4.3949     2.7314 
   H 164    4.8213    15.1390     4.7896     5.4294    16.1015    14.4332 
   H 165    5.0105    14.3825     3.7217     4.3949    15.3574    13.7160 
   H 166    1.0813    11.6132     5.9959     5.7676    12.4784    10.7467 
   H 167    1.5967    11.6224     5.2193     5.0351    12.5189    10.7936 
   H 168   12.4358     5.9959    14.6316    13.7066     5.7676     5.3768 
   H 169   12.1287     5.2192    14.0160    13.0779     5.0350     4.5822 
   H 170   12.3020     7.1309    15.0486    14.1560     6.9507     6.4540 
   H 171   11.2282     6.9430    14.0907    13.2147     6.9148     6.1591 
   H 172    0.6200    12.3406     7.1309     6.9507    13.1637    11.4350 
   H 173    0.6200    13.2255     6.9430     6.9148    14.0731    12.3413 
   H 174    4.5200    16.9050    10.3640    10.5463    17.6952    15.9765 
   H 175    7.2789    19.7360    12.5419    12.8683    20.5264    18.8080 
   H 176    7.7589    11.9254    13.3317    12.7802    12.3022    10.9421 
   H 177    7.3541    14.3972    13.7460    13.3803    14.8623    13.3998 
   H 178   11.2236    14.6098    17.0514    16.5112    14.7933    13.6832 
   H 179   11.0764    16.7734    17.4587    17.0632    17.0652    15.8079 
   H 180    3.6520    12.6913    10.0479     9.7350    13.3570    11.7079 
   H 181    4.7214     9.9419     9.6217     9.0503    10.5689     8.9492 
   H 182    4.5258    16.7441     7.7598     8.2316    17.6477    15.9239 
   H 183    7.0850    19.5259    10.3570    10.9220    20.4161    18.6876 

              C  55      C  56      C  57      C  58      C  59      C  60
              ------------------------------------------------------------------
   C  55    0.0000 
   C  56   12.2768     0.0000 
   C  57    1.0000    11.7696     0.0000 
   C  58    1.7320    10.7700     1.0000     0.0000 
   C  59   13.2760     1.0001    12.7693    11.7697     0.0000 
   C  60    2.0000    10.2791     1.7320     1.0000    11.2779     0.0000 
   C  61   13.7690     1.7321    13.3187    12.3231     1.0000    11.7697 
   C  62    2.0000    13.4578     3.0000     3.6055    14.4445     3.4641 
   C  63   10.9604     3.0000    10.6740     9.7162     3.6056     9.0040 
   C  64    3.0000    14.1177     4.0000     4.5826    15.0944     4.3589 
   C  65   10.6740     4.0000    10.4756     9.5503     4.5826     8.7679 
   C  66    3.6056    15.0944     4.5826     5.2915    16.0739     5.1962 
   C  67    9.7162     4.5826     9.5503     8.6417     5.2915     7.8324 
   C  68    9.0040     4.3589     8.7679     7.8324     5.1962     7.0719 
   C  69    3.4641    15.4329     4.3589     5.1962    16.4227     5.2915 
   C  70    9.3417     3.4641     9.0040     8.0338     4.3589     7.3626 
   C  71    2.6458    14.8316     3.4641     4.3589    15.8275     4.5826 
   C  72   12.0081     1.9317    11.3695    10.3796     2.3941    10.0566 
   C  73    2.7321    12.4597     1.9319     2.3941    13.4453     3.3858 
   C  74   14.9081     3.6055    14.5621    13.5840     2.9999    12.9303 
   C  75    3.4640     9.5390     3.6055     2.9999    10.5131     2.0000 
   C  76   11.2791     2.7320    10.5967     9.6173     3.3461     9.3608 
   C  77    3.3461    13.4047     2.7321     3.3461    14.3858     4.3198 
   C  78    4.4641    16.3671     5.3535     6.1961    17.3536     6.2763 
   C  79    8.3036     5.3536     8.1539     7.2587     6.1962     6.4308 
   C  80   11.5770     3.6327    10.8336     9.8777     4.1145     9.7176 
   C  81    4.3198    13.6408     3.6327     4.1144    14.6060     5.1112 
   C  82    4.3589     9.3090     4.5826     4.0000    10.2562     3.0000 
   C  83   15.5431     4.5826    15.2444    14.2780     4.0000    13.5841 
   C  84    5.0000    15.5467     6.0000     6.5574    16.4995     6.2450 
   C  85   10.3703     6.0000    10.3608     9.5298     6.5574     8.6304 
   C  86    4.3198    11.9828     3.3859     3.4253    12.9378     4.3814 
   C  87   13.2205     3.3858    12.5055    11.5381     3.4252    11.3251 
   C  88    4.7321    12.9624     3.8982     4.1468    13.9124     5.1373 
   C  89   12.5622     3.8982    11.8075    10.8576     4.1468    10.7122 
   C  90   14.1973     4.0576    13.4699    12.5078     3.8730    12.3116 
   C  91    5.0391    11.3375     4.0576     3.8730    12.2722     4.7396 
   H  92   12.6937     2.2901    12.3512    11.3756     2.3716    10.7159 
   H  93    0.8743    12.4644     1.8397     2.3716    13.4585     2.2901 
   H  94   13.9363     2.3716    13.5427    12.5553     1.8396    11.9449 
   H  95    1.8396    11.2438     2.3715     2.2901    12.2301     1.6200 
   H  96    0.6200    12.6208     1.6200     2.2901    13.6175     2.3715 
   H  97   11.4569     0.8743    10.9748     9.9768     1.8397     9.4574 
   H  98   11.6574     0.6200    11.1499    10.1504     1.6200     9.6601 
   H  99    1.6200    11.4876     0.6200     0.8743    12.4851     1.8396 
   H 100    1.9850    10.9648     1.0312     0.6200    11.9616     1.6069 
   H 101   13.1538     1.0313    12.6075    11.6078     0.6200    11.1627 
   H 102    2.5067     9.7911     2.0294     1.0812    10.7911     0.6200 
   H 103    2.5068     9.8348     2.3451     1.5968    10.8307     0.6200 
   H 104   14.2401     2.0295    13.7630    12.7648     1.0812    12.2402 
   H 105   14.2585     2.3452    13.8320    12.8392     1.5968    12.2616 
   H 106   11.3756     3.3533    11.1278    10.1822     3.8242     9.4395 
   H 107    2.3716    13.2556     3.3533     3.8242    14.2345     3.5191 
   H 108   11.2716     3.7289    11.0559    10.1224     4.2029     9.3547 
   H 109    2.7431    13.5139     3.7289     4.2029    14.4885     3.8787 
   H 110   10.1821     4.8212    10.0548     9.1624     5.4428     8.3293 
   H 111    4.0601    15.7013     5.0104     5.7745    16.6824     5.7415 
   H 112   13.7034     3.3533    13.4100    12.4466     3.1407    11.7459 
   H 113    2.8291    10.9412     3.3532     3.1407    11.9105     2.2901 
   H 114    3.0890     9.3764     2.4104     1.4158    10.3751     1.3894 
   H 115    3.0890    10.0044     2.1763     1.4157    10.9949     2.0194 
   H 116   14.6861     2.4105    14.1687    13.1688     1.4158    12.6889 
   H 117   14.2280     2.1763    13.6540    12.6559     1.4157    12.2438 
   H 118    3.1513    15.3939     3.8918     4.8282    16.3911     5.1245 
   H 119    2.4060    14.6789     3.1022     4.0507    15.6776     4.3998 
   H 120    8.7378     3.8917     8.3886     7.4165     4.8282     6.7543 
   H 121    9.3908     3.1022     8.9904     8.0051     4.0507     7.3958 
   H 122    2.4808    12.9399     1.8699     2.5632    13.9300     3.5074 
   H 123   11.4217     1.8698    10.7982     9.8054     2.5632     9.4627 
   H 124   10.4571     1.8396     9.9768     8.9792     2.8292     8.4577 
   H 125    1.4158    13.5750     1.8397     2.8292    14.5751     3.3533 
   H 126   14.7289     3.1102    14.3455    13.3596     2.4267    12.7402 
   H 127   15.4586     3.8982    15.0938    14.1112     3.1671    13.4751 
   H 128    3.1021     9.5185     3.1101     2.4267    10.5047     1.4332 
   H 129    3.8917     8.9229     3.8981     3.1671     9.8987     2.1944 
   H 130   10.8489     3.2836    10.1376     9.1677     3.9482     8.9583 
   H 131    3.8098    13.9944     3.2837     3.9482    14.9727     4.9119 
   H 132    8.7739     5.4466     8.6682     7.7923     6.2272     6.9387 
   H 133    7.9019     5.9711     7.8134     6.9517     6.8162     6.0821 
   H 134    7.8541     5.3315     7.6552     6.7398     6.2272     5.9440 
   H 135    4.5070    16.1629     5.4465     6.2271    17.1431     6.2078 
   H 136    5.0842    16.9502     5.9712     6.8162    17.9345     6.8891 
   H 137    4.5069    16.5919     5.3315     6.2271    17.5834     6.4044 
   H 138    8.9847     5.9770     8.9526     8.1154     6.7056     7.2212 
   H 139    5.0104    16.3813     5.9770     6.7056    17.3528     6.6018 
   H 140    3.4849    13.2632     4.4186     4.7206    14.2198     4.2029 
   H 141   12.0001     4.4187    11.8400    10.9278     4.7206    10.1224 
   H 142    7.9548     4.6094     7.6164     6.6492     5.5659     5.9736 
   H 143    3.9142    16.1720     4.6095     5.5659    17.1697     5.8979 
   H 144    4.3808    14.2020     3.8111     4.4133    15.1718     5.3942 
   H 145    4.9339    14.0118     4.2523     4.7158    14.9673     5.7145 
   H 146   10.9664     3.8109    10.2175     9.2640     4.4133     9.1164 
   H 147   11.5904     4.2523    10.8112     9.8746     4.7158     9.7771 
   H 148    4.6402     8.6998     4.7390     4.0478     9.6511     3.0634 
   H 149    4.9339     9.2183     5.1927     4.6200    10.1433     3.6200 
   H 150    4.1517     9.9196     4.5067     4.0477    10.8630     3.0634 
   H 151   16.0172     4.7391    15.6933    14.7199     4.0478    14.0479 
   H 152   15.9555     5.1928    15.6844    14.7259     4.6200    14.0099 
   H 153   15.0795     4.5068    14.8078    13.8497     4.0478    13.1332 
   H 154    4.4739    14.9403     5.4719     5.9890    15.8956     5.6451 
   H 155    5.3371    15.4324     6.3328     6.8179    16.3729     6.4222 
   H 156    5.5457    16.1543     6.5443     7.1346    17.1046     6.8485 
   H 157   10.7232     5.4719    10.6639     9.8038     5.9890     8.9320 
   H 158   10.8938     6.3328    10.9132    10.0970     6.8179     9.1856 
   H 159   10.0432     6.5443    10.0868     9.2891     7.1346     8.3639 
   H 160   12.7927     4.5137    12.0078    11.0751     4.7301    10.9815 
   H 161    5.3521    13.1760     4.5139     4.7302    14.1117     5.7135 
   H 162    9.8761     3.5217     9.1838     8.2067     4.3521     7.9721 
   H 163   10.1903     2.5563     9.5770     8.5822     3.4640     8.2286 
   H 164    3.7951    14.7483     3.5218     4.3521    15.7348     5.2420 
   H 165    2.7315    14.0854     2.5564     3.4640    15.0796     4.2883 
   H 166    5.3768    10.8149     4.3801     4.0620    11.7392     4.8518 
   H 167    4.5823    10.9347     3.5870     3.3133    11.8832     4.1498 
   H 168   14.8114     4.3801    14.0875    13.1241     4.0620    12.9209 
   H 169   14.2317     3.5869    13.5356    12.5617     3.3132    12.3168 
   H 170   15.1525     5.4699    14.3759    13.4388     5.2328    13.3215 
   H 171   14.1637     5.2225    13.3699    12.4432     5.1850    12.3600 
   H 172    6.4540    11.4114     5.4699     5.2328    12.2970     6.0480 
   H 173    6.1591    12.3630     5.2225     5.1850    13.2659     6.0954 
   H 174    9.4457    15.8766     8.6512     8.8688    16.7157     9.8411 
   H 175   11.5702    18.7029    10.8964    11.2705    19.5353    12.2660 
   H 176   12.9455    10.3139    11.9597    11.3417    10.7474    11.7806 
   H 177   13.1744    12.8623    12.1760    11.7615    13.3810    12.3985 
   H 178   16.6394    12.9000    15.6479    15.0573    13.1076    15.5114 
   H 179   16.9022    15.1100    15.9032    15.4680    15.4334    16.0742 
   H 180    9.4500    11.4204     8.4532     8.0788    12.1560     8.7706 
   H 181    9.2822     8.6139     8.3111     7.6423     9.3307     8.0512 
   H 182    6.7643    16.0578     6.2323     6.8108    16.9979     7.8003 
   H 183    9.3578    18.7816     8.9383     9.5874    19.7055    10.5649 

              C  61      C  62      C  63      C  64      C  65      C  66
              ------------------------------------------------------------------
   C  61    0.0000 
   C  62   14.8316     0.0000 
   C  63    3.4641    11.7696     0.0000 
   C  64   15.4329     1.0000    12.2768     0.0000 
   C  65    4.3589    11.3282     1.0000    11.7696     0.0000 
   C  66   16.4227     1.7321    13.2760     1.0001    12.7693     0.0000 
   C  67    5.1962    10.3343     1.7320    10.7700     1.0000    11.7697 
   C  68    5.2915     9.7706     2.0000    10.2791     1.7320    11.2779 
   C  69   16.8237     2.0000    13.7690     1.7321    13.3187     1.0000 
   C  70    4.5826    10.2791     1.7320    10.8562     2.0000    11.8485 
   C  71   16.2740     1.7321    13.3187     2.0000    12.9303     1.7320 
   C  72    3.3858    13.4183     4.5747    14.1767     5.5371    15.1166 
   C  73   14.1011     4.5748    11.7836     5.5372    11.7213     5.8874 
   C  74    2.0000    15.7684     4.0000    16.2739     4.5826    17.2734 
   C  75   10.8563     3.9999     7.7720     4.5825     7.3626     5.5677 
   C  76    4.3198    12.7701     4.9659    13.5648     5.8645    14.4846 
   C  77   15.0581     4.9659    12.7786     5.8645    12.7212     6.0547 
   C  78   17.7336     2.9093    14.6321     2.3942    14.1481     1.4142 
   C  79    6.2764     8.9375     2.9093     9.3991     2.3941    10.3991 
   C  80    5.1112    13.1662     5.9656    14.0003     6.8595    14.8932 
   C  81   15.3253     5.9656    13.2241     6.8595    13.2342     7.0229 
   C  82   10.5130     4.5826     7.2849     5.0000     6.7730     6.0000 
   C  83    3.0000    16.3089     4.5826    16.7683     5.0001    17.7682 
   C  84   16.7501     3.0000    13.4578     2.0000    12.8420     1.7321 
   C  85    6.2450    10.6740     3.0000    10.9604     2.0000    11.9441 
   C  86   13.6815     6.2492    11.7298     7.2284    11.8147     7.6145 
   C  87    4.3813    14.7501     6.2491    15.5550     7.2282    16.4688 
   C  88   14.6658     6.5410    12.7288     7.4820    12.8071     7.7447 
   C  89    5.1373    14.1632     6.5410    14.9996     7.4820    15.8908 
   C  90    4.7396    15.7420     7.0177    16.5510     8.0110    17.4623 
   C  91   13.0539     7.0178    11.3020     8.0111    11.4659     8.4641 
   H  92    1.8397    13.5750     1.8397    14.1017     2.6009    15.1000 
   H  93   13.8955     1.2346    10.9504     2.2146    10.5875     2.9435 
   H  94    0.8743    14.8947     3.2380    15.4489     4.0130    16.4451 
   H  95   12.6209     2.2145     9.5976     2.9435     9.2021     3.8787 
   H  96   14.0766     1.3800    11.1793     2.3800    10.8416     3.0074 
   H  97    2.3716    12.6053     2.3716    13.2556     3.3533    14.2345 
   H  98    2.2901    12.8471     2.7431    13.5139     3.7289    14.4885 
   H  99   13.0702     3.6200    10.5403     4.6200    10.3991     5.1927 
   H 100   12.5543     3.9615    10.0632     4.9569     9.9473     5.5902 
   H 101    1.6069    14.3933     3.9616    15.0745     4.9569    16.0453 
   H 102   11.3136     4.0760     8.6472     4.9779     8.4701     5.8077 
   H 103   11.2904     3.7220     8.4550     4.5429     8.1900     5.4395 
   H 104    0.6200    15.3461     4.0761    15.9645     4.9779    16.9513 
   H 105    0.6200    15.2731     3.7220    15.8508     4.5429    16.8443 
   H 106    3.5191    12.1060     0.6201    12.5751     0.8743    13.5751 
   H 107   14.5848     0.6200    11.4569     0.8743    10.9748     1.8397 
   H 108    3.8787    11.9449     0.8743    12.3894     0.6201    13.3892 
   H 109   14.8199     0.8743    11.6574     0.6200    11.1499     1.6200 
   H 110    5.2330    10.7158     1.8397    11.1088     0.8743    12.1060 
   H 111   17.0369     2.2901    13.8954     1.6200    13.3891     0.6200 
   H 112    2.2901    14.4809     2.7431    14.9550     3.2069    15.9551 
   H 113   12.2301     2.7430     9.0775     3.2069     8.6002     4.2029 
   H 114   10.9500     4.7965     8.4572     5.7217     8.3702     6.5226 
   H 115   11.6317     5.0153     9.3230     5.9966     9.3020     6.6852 
   H 116    1.3894    15.8599     4.7965    16.5065     5.7218    17.4872 
   H 117    2.0194    15.5061     5.0154    16.2000     5.9966    17.1670 
   H 118   16.8509     2.3452    13.9189     2.5069    13.5398     2.0295 
   H 119   16.1576     2.0296    13.2807     2.5069    12.9362     2.3451 
   H 120    5.1245     9.7114     2.3451    10.3098     2.5068    11.2986 
   H 121    4.3998    10.4360     2.0295    11.0577     2.5068    12.0424 
   H 122   14.5640     4.1798    12.1584     5.1117    12.0536     5.3903 
   H 123    3.5074    12.8127     4.1798    13.5653     5.1116    14.5078 
   H 124    3.3533    11.6183     2.2900    12.2801     3.1407    13.2556 
   H 125   15.0999     2.2901    12.3512     3.1408    12.0821     3.3533 
   H 126    1.4332    15.6599     3.9399    16.1981     4.6339    17.1958 
   H 127    2.1944    16.3481     4.5875    16.8643     5.1957    17.8635 
   H 128   10.9017     3.9399     7.9286     4.6338     7.5905     5.5908 
   H 129   10.2520     4.5875     7.2028     5.1956     6.8289     6.1774 
   H 130    4.9119    12.3918     5.2894    13.2092     6.1409    14.1142 
   H 131   15.6541     5.2895    13.3959     6.1409    13.3411     6.2373 
   H 132    6.2079     9.3096     2.7584     9.7218     2.0631    10.7207 
   H 133    6.8891     8.4392     3.4980     8.8663     2.9035     9.8659 
   H 134    6.4045     8.5939     3.1763     9.1071     2.8243    10.1053 
   H 135   17.4922     2.7584    14.3386     2.0632    13.8220     1.0698 
   H 136   18.3024     3.4981    15.1757     2.9036    14.6731     1.9038 
   H 137   17.9931     3.1762    14.9455     2.8243    14.4934     1.9037 
   H 138    6.6018     9.3743     3.1407     9.7187     2.2900    10.7119 
   H 139   17.6656     3.1408    14.4534     2.2901    13.8954     1.4158 
   H 140   14.4885     1.8396    11.2331     1.4157    10.6586     2.2901 
   H 141    4.2029    12.5553     1.8397    12.9403     1.4158    13.9364 
   H 142    5.8979     8.9341     3.0770     9.5441     3.0890    10.5303 
   H 143   17.6334     3.0771    14.7026     3.0891    14.3194     2.4104 
   H 144   15.8788     5.8759    13.7153     6.7226    13.6960     6.8000 
   H 145   15.7089     6.5472    13.6940     7.4248    13.7329     7.5479 
   H 146    5.3942    12.5693     5.8757    13.4109     6.7225    14.2979 
   H 147    5.7145    13.2383     6.5472    14.0965     7.4247    14.9695 
   H 148    9.9236     5.0675     6.7320     5.5456     6.2607     6.5443 
   H 149   10.3432     5.0104     7.0376     5.3370     6.4584     6.3328 
   H 150   11.1057     4.1339     7.8479     4.4738     7.3020     5.4719 
   H 151    3.0634    16.8253     5.0676    17.3020     5.5456    18.3021 
   H 152    3.6200    16.6652     5.0105    17.0970     5.3371    18.0958 
   H 153    3.0635    15.7999     4.1339    16.2407     4.4739    17.2400 
   H 154   16.1556     2.4825    12.8781     1.4956    12.2769     1.5201 
   H 155   16.5881     3.3533    13.2556     2.3716    12.6053     2.2901 
   H 156   17.3464     3.5506    14.0410     2.5559    13.4119     2.1115 
   H 157    5.6452    11.1143     2.4825    11.4367     1.4956    12.4259 
   H 158    6.4222    11.1278     3.3533    11.3756     2.3716    12.3513 
   H 159    6.8485    10.2523     3.5506    10.4992     2.5559    11.4756 
   H 160    5.7135    14.4425     7.1543    15.2988     8.0903    16.1736 
   H 161   14.8911     7.1544    13.0702     8.0905    13.1873     8.3340 
   H 162    5.2420    11.3987     4.9398    12.2117     5.6922    13.1194 
   H 163    4.2883    11.5795     3.9131    12.3373     4.7158    13.2769 
   H 164   16.3846     4.9399    13.9973     5.6923    13.8826     5.6448 
   H 165   15.6882     3.9132    13.1753     4.7158    13.0122     4.7723 
   H 166   12.5372     7.3730    10.8880     8.3717    11.0941     8.8753 
   H 167   12.6407     6.5772    10.7876     7.5757    10.9228     8.0796 
   H 168    4.8518    16.3469     7.3730    17.1506     8.3717    18.0654 
   H 169    4.1497    15.7224     6.5771    16.5082     7.5756    17.4339 
   H 170    6.0480    16.7767     8.4334    17.6178     9.4263    18.5056 
   H 171    6.0954    15.8216     8.0780    16.6787     9.0507    17.5528 
   H 172   13.1432     8.4334    11.7403     9.4263    12.0155     9.8688 
   H 173   14.0921     8.0781    12.5393     9.0507    12.7554     9.3971 
   H 174   17.6050    11.1345    16.3589    12.0148    16.6372    12.1055 
   H 175   20.4301    13.0440    19.1736    13.8306    19.4311    13.7474 
   H 176   11.7469    14.9227    12.3466    15.9134    13.1070    16.5420 
   H 177   14.3796    15.1718    14.6213    16.1708    15.2936    16.6558 
   H 178   14.0721    18.6252    15.3253    19.6192    16.1767    20.2249 
   H 179   16.4208    18.9006    17.2929    19.9000    18.0727    20.3878 
   H 180   13.1057    11.4453    12.5050    12.4435    13.0010    12.9240 
   H 181   10.2865    11.2398     9.8929    12.2237    10.4766    12.8875 
   H 182   17.7686     8.0984    15.8432     8.8599    15.8973     8.7723 
   H 183   20.5022    10.4363    18.6596    11.0721    18.7259    10.7965 

              C  67      C  68      C  69      C  70      C  71      C  72
              ------------------------------------------------------------------
   C  67    0.0000 
   C  68    1.0000     0.0000 
   C  69   12.3231    11.7697     0.0000 
   C  70    1.7320     1.0000    12.2769     0.0000 
   C  71   11.9441    11.3282     1.0000    11.7697     0.0000 
   C  72    5.8873     5.3785    15.3334     4.3813    14.6350     0.0000 
   C  73   10.8563     9.9897     5.3786    10.0627     4.3814    11.7696 
   C  74    5.5677     6.0000    17.7681     5.5677    17.3063     5.3784 
   C  75    6.3780     5.7745     6.0000     6.2882     5.5677     9.6918 
   C  76    6.0547     5.4033    14.6517     4.4118    13.9192     1.0001 
   C  77   11.8561    10.9896     5.4033    11.0560     4.4118    12.6584 
   C  78   13.1494    12.6323     1.0000    13.1720     1.9318    16.3040 
   C  79    1.4142     1.0001    10.9305     1.9319    10.5362     6.2920 
   C  80    7.0229     6.3344    14.9982     5.3536    14.2227     1.7322 
   C  81   12.4049    11.5045     6.3344    11.4928     5.3536    12.7628 
   C  82    5.7744     5.2925     6.5575     5.9335     6.2450     9.6607 
   C  83    6.0000     6.5575    18.3041     6.2450    17.8842     6.3765 
   C  84   11.8485    11.4914     2.6458    12.1758     3.4641    15.7745 
   C  85    1.7320     2.6457    12.6094     3.4641    12.3612     7.4916 
   C  86   11.0358    10.0991     7.1075     9.9996     6.1091    11.0515 
   C  87    7.6144     7.1074    16.6160     6.1090    15.8650     1.7320 
   C  88   12.0205    11.0889     7.1263    10.9984     6.1310    11.9933 
   C  89    7.7447     7.1263    15.9893     6.1310    15.2074     2.0000 
   C  90    8.4641     8.0110    17.6012     7.0177    16.8427     2.6458 
   C  91   10.7425     9.7777     8.0110     9.5849     7.0177    10.2998 
   H  92    3.5192     3.8242    15.5751     3.3533    15.0999     4.2135 
   H  93    9.6086     8.9651     3.0074     9.3909     2.3800    12.3267 
   H  94    4.9340     5.1927    16.8936     4.6200    16.3884     4.1761 
   H  95    8.2175     7.6036     4.2029     8.0778     3.7289    11.2394 
   H  96    9.8687     9.2021     2.9436     9.5976     2.2146    12.4280 
   H  97    3.8242     3.5191    14.5848     2.6008    13.9964     2.2168 
   H  98    4.2029     3.8787    14.8199     2.9435    14.2146     1.8698 
   H  99    9.4990     8.6763     4.9340     8.8450     4.0131    11.0007 
   H 100    9.0608     8.2199     5.3900     8.3598     4.4917    10.4678 
   H 101    5.5902     5.3900    16.3581     4.4917    15.7326     1.8439 
   H 102    7.5606     6.7538     5.8749     6.9746     5.1331     9.5041 
   H 103    7.2454     6.5060     5.6350     6.8366     4.9969     9.7036 
   H 104    5.8077     5.8749    17.3339     5.1331    16.7661     3.4014 
   H 105    5.4395     5.6350    17.2693     4.9969    16.7406     3.9907 
   H 106    1.8397     2.3716    14.1017     2.2901    13.6851     5.0484 
   H 107    9.9768     9.4574     2.3716    10.0129     2.2901    13.3027 
   H 108    1.6200     2.2901    13.9364     2.3716    13.5428     5.4022 
   H 109   10.1504     9.6601     2.2901    10.2417     2.3716    13.5984 
   H 110    0.6200     1.6199    12.6937     2.2900    12.3512     6.2624 
   H 111   12.3894    11.8972     0.8743    12.4644     1.8397    15.7030 
   H 112    4.2029     4.7206    16.4778     4.4186    16.0487     5.2788 
   H 113    7.6036     7.0782     4.7206     7.6509     4.4186    11.1059 
   H 114    7.5058     6.6391     6.5283     6.7484     5.7347     8.9640 
   H 115    8.4693     7.5711     6.5282     7.5969     5.6402     9.4084 
   H 116    6.5226     6.5283    17.8384     5.7347    17.2419     3.3520 
   H 117    6.6852     6.5282    17.4632     5.6402    16.8215     2.4808 
   H 118   12.5551    11.9309     1.0812    12.3596     0.6200    15.1593 
   H 119   11.9596    11.3026     1.5967    11.6952     0.6200    14.4051 
   H 120    2.0295     1.0812    11.7065     0.6200    11.1831     4.5791 
   H 121    2.3451     1.5967    12.4259     0.6200    11.8761     3.8273 
   H 122   11.1662    10.3257     4.8294    10.4479     3.8295    12.3020 
   H 123    5.3903     4.8294    14.7336     3.8295    14.0436     0.6200 
   H 124    3.3533     2.8292    13.5943     1.8397    12.9996     2.5563 
   H 125   11.1278    10.4045     2.8292    10.7159     1.8397    13.2077 
   H 126    5.5908     5.9238    17.6596     5.3983    17.1673     4.8181 
   H 127    6.1774     6.5860    18.3481     6.1177    17.8747     5.5601 
   H 128    6.6235     5.9474     5.9238     6.3732     5.3983     9.5474 
   H 129    5.8539     5.2106     6.5860     5.6918     6.1177     9.0746 
   H 130    6.2373     5.5106    14.2480     4.5425    13.4936     1.6201 
   H 131   12.4760    11.6094     5.5106    11.6723     4.5425    13.2173 
   H 132    1.0698     1.1767    11.2919     2.1764    10.9390     6.5504 
   H 133    1.9038     1.6200    10.4245     2.5358    10.0638     6.8704 
   H 134    1.9038     1.1767    10.5930     1.8700    10.1552     6.0860 
   H 135   12.8221    12.3415     1.1766    12.9175     2.1763    16.1708 
   H 136   13.6735    13.1769     1.6200    13.7344     2.5358    16.9076 
   H 137   13.4973    12.9462     1.1766    13.4504     1.8698    16.4596 
   H 138    1.4158     1.8397    11.3340     2.8292    11.0401     7.1761 
   H 139   12.8963    12.4644     1.8397    13.0835     2.8292    16.4661 
   H 140    9.6601     9.2522     3.1408     9.9085     3.3533    13.4883 
   H 141    2.2901     3.1408    14.5319     3.3533    14.1901     6.2077 
   H 142    2.4104     1.4158    10.9278     1.3894    10.3993     5.1117 
   H 143   13.3335    12.7139     1.4158    13.1440     1.3894    15.9194 
   H 144   12.8491    11.9643     6.0514    11.9864     5.0943    13.3531 
   H 145   12.9192    12.0065     6.8230    11.9620     5.8560    13.0676 
   H 146    6.7999     6.0513    14.3924     5.0942    13.6117     2.0296 
   H 147    7.5479     6.8230    15.0334     5.8560    14.2318     2.3452 
   H 148    5.2670     4.7336     7.0589     5.3413     6.6898     9.0408 
   H 149    5.4591     5.0703     6.9530     5.7900     6.7055     9.6933 
   H 150    6.3020     5.8636     6.0780     6.5308     5.8323    10.2805 
   H 151    6.5443     7.0589    18.8228     6.6898    18.3856     6.4419 
   H 152    6.3328     6.9530    18.6556     6.7055    18.2608     6.9955 
   H 153    5.4719     6.0779    17.7919     5.8323    17.3905     6.3711 
   H 154   11.2813    10.9057     2.5121    11.5782     3.1995    15.1568 
   H 155   11.6183    11.3089     3.2380    12.0294     4.0130    15.7356 
   H 156   12.4208    12.0807     2.9084    12.7755     3.8122    16.3926 
   H 157    1.5200     2.5121    13.0666     3.1995    12.7854     7.0317 
   H 158    2.2901     3.2380    13.0434     4.0130    12.8278     7.9084 
   H 159    2.1115     2.9083    12.1665     3.8121    11.9541     7.9732 
   H 160    8.3339     7.6931    16.2372     6.7018    15.4331     2.6200 
   H 161   12.4248    11.4792     7.6932    11.3445     6.7019    12.1289 
   H 162    5.6448     4.8297    13.2633     3.9148    12.5187     2.2902 
   H 163    4.7723     4.0478    13.4988     3.0754    12.8100     1.8398 
   H 164   12.9869    12.1568     4.8297    12.2876     3.9148    14.0487 
   H 165   12.0965    11.2961     4.0478    11.4835     3.0754    13.5004 
   H 166   10.4035     9.4266     8.4694     9.1832     7.4837     9.7323 
   H 167   10.1816     9.2244     7.6835     9.0639     6.7011     9.9750 
   H 168    8.8753     8.4694    18.2113     7.4837    17.4566     3.1512 
   H 169    8.0795     7.6834    17.6077     6.7011    16.8732     2.4059 
   H 170    9.8688     9.3914    18.5902     8.3943    17.7951     4.0130 
   H 171    9.3971     8.8338    17.6115     7.8342    16.8020     3.5192 
   H 172   11.3746    10.3851     9.3914    10.0654     8.3943    10.1694 
   H 173   12.0648    11.0886     8.8338    10.8394     7.8342    11.1788 
   H 174   15.9829    14.9977    11.3292    14.6883    10.3910    14.4758 
   H 175   18.7549    17.7759    12.8670    17.4940    12.0175    17.2794 
   H 176   12.9871    12.0905    16.2323    11.2617    15.2623     8.4065 
   H 177   15.0428    14.0913    16.1872    13.3585    15.1894    11.0013 
   H 178   16.1953    15.3647    19.8788    14.4656    18.8984    10.9776 
   H 179   17.9652    17.0673    19.9133    16.2393    18.9147    13.1797 
   H 180   12.5573    11.5626    12.4649    11.0020    11.4685     9.8087 
   H 181   10.1439     9.1732    12.6361     8.5004    11.6869     6.9776 
   H 182   15.0881    14.1724     7.9053    14.1117     7.0413    15.0176 
   H 183   17.9194    17.0022     9.8420    16.9291     9.1209    17.6557 

              C  73      C  74      C  75      C  76      C  77      C  78
              ------------------------------------------------------------------
   C  73    0.0000 
   C  74   15.5233     0.0000 
   C  75    5.3784    11.7697     0.0000 
   C  76   10.9003     6.2919     9.1588     0.0000 
   C  77    1.0001    16.5028     6.2919    11.7697     0.0000 
   C  78    6.2920    18.6319     6.8841    15.6327     6.2334     0.0000 
   C  79    9.5082     6.8842     4.9686     6.2335    10.5062    11.7696 
   C  80   10.9618     7.1075     9.7035     1.0001    11.7843    15.9892 
   C  81    1.7320    16.8500     7.1074    11.8397     1.0000     7.1263 
   C  82    6.3765    11.2779     1.0001     9.2203     7.2838     7.3751 
   C  83   16.2801     1.0001    12.3232     7.2838    17.2668    19.1437 
   C  84    7.4917    17.4136     6.0827    15.2270     7.7367     2.5036 
   C  85   11.8516     6.0828     6.9149     7.7367    12.8414    13.3534 
   C  86    1.7320    15.2571     6.3344    10.1206     2.0000     8.0110 
   C  87   12.6852     6.3343    11.1588     2.0000    13.5138    17.6011 
   C  88    2.0000    16.2525     7.1262    11.0513     1.7321     7.9652 
   C  89   11.8832     7.1262    10.6993     1.7321    12.6854    16.9813 
   C  90   13.6001     6.5873    12.1588     3.0000    14.4109    18.5879 
   C  91    2.6457    14.6969     6.5873     9.3476     3.0000     8.9351 
   H  92   13.3436     2.2146     9.5751     4.9287    14.3283    16.4487 
   H  93    3.6001    14.9329     3.2380    11.6460     4.1654     3.9873 
   H  94   14.4295     1.2347    10.8984     5.0705    15.4010    17.7814 
   H  95    4.3028    13.5910     1.8396    10.6213     5.0706     5.1235 
   H  96    3.2837    15.1518     3.5190    11.7251     3.8098     3.9394 
   H  97   11.7297     4.0130     8.6750     2.7519    12.6867    15.5143 
   H  98   11.8500     4.0601     8.9381     2.4808    12.7980    15.7564 
   H  99    1.5565    14.3784     3.8241    10.2000     2.4809     5.9227 
   H 100    1.8439    13.8806     3.6024     9.6671     2.8262     6.3848 
   H 101   13.2013     3.6024    10.5039     2.8262    14.1270    17.3017 
   H 102    3.4015    12.5337     2.1943     8.7887     4.3807     6.8649 
   H 103    3.9907    12.4020     1.4331     9.0482     4.9339     6.6007 
   H 104   14.4866     2.1943    11.3836     4.3807    15.4334    18.2518 
   H 105   14.6541     1.4331    11.2849     4.9339    15.6163    18.1685 
   H 106   12.2906     3.7288     8.1214     5.5039    13.2881    14.9456 
   H 107    5.0485    15.4564     3.7288    12.6910     5.5039     3.1762 
   H 108   12.2680     3.9754     7.9751     5.8301    13.2672    14.7675 
   H 109    5.4023    15.6543     3.9754    13.0005     5.8301     3.0084 
   H 110   11.4046     5.3763     6.7992     6.5032    12.4035    13.4973 
   H 111    6.1762    17.8931     6.1809    15.0599     6.2506     0.8310 
   H 112   14.4720     1.4158    10.4909     6.0658    15.4621    17.3249 
   H 113    5.2788    13.0767     1.4158    10.5623     6.0658     5.5561 
   H 114    3.3520    12.2646     2.7897     8.2067     4.3521     7.5253 
   H 115    2.4808    13.0426     3.7716     8.5822     3.4640     7.5253 
   H 116   14.8043     2.7897    11.9245     4.3521    15.7347    18.7689 
   H 117   14.1718     3.7716    11.6358     3.4640    15.0796    18.4126 
   H 118    4.5792    17.9030     6.1774    14.4272     4.4738     1.7618 
   H 119    3.8274    17.2521     5.5909    13.6617     3.8069     2.4655 
   H 120    9.4436     6.1774     5.7317     4.4738    10.4372    12.6105 
   H 121    9.9419     5.5909     6.4754     3.8069    10.9267    13.3409 
   H 122    0.6201    15.9450     5.4557    11.4460     0.8744     5.7222 
   H 123   11.2463     5.4557     9.0741     0.8744    12.1478    15.7018 
   H 124   10.7553     4.8707     7.7036     2.7314    11.7180    14.5276 
   H 125    2.5564    16.2835     4.8707    12.4363     2.7314     3.7683 
   H 126   15.2422     0.6199    11.6608     5.7514    16.2141    18.5399 
   H 127   16.0166     0.6200    12.3483     6.5095    16.9911    19.2175 
   H 128    4.8182    11.9098     0.6199     8.9615     5.7514     6.8489 
   H 129    5.5601    11.1955     0.6200     8.5498     6.5095     7.4826 
   H 130   10.3732     6.8704     8.8691     0.6200    11.2282    15.2346 
   H 131    1.6201    17.1112     6.8704    12.3186     0.6200     6.2774 
   H 132   10.0683     6.6376     5.3850     6.5764    11.0643    12.1060 
   H 133    9.2514     7.4471     4.5083     6.7713    10.2442    11.2463 
   H 134    8.9559     7.1762     4.5983     5.9358     9.9554    11.4569 
   H 135    6.5504    18.3348     6.6375    15.5283     6.5763     0.6200 
   H 136    6.8705    19.1741     7.4471    16.2421     6.7713     0.6201 
   H 137    6.0860    18.9446     7.1760    15.7608     5.9357     0.6200 
   H 138   10.4361     6.8428     5.5424     7.2403    11.4257    12.1121 
   H 139    7.1762    18.4385     6.8428    15.8540     7.2403     1.2564 
   H 140    6.2078    15.2100     3.7979    12.9524     6.7138     3.6973 
   H 141   13.1221     3.7979     8.6346     6.7138    14.1222    15.3307 
   H 142    8.7110     6.9567     4.9626     4.8762     9.7076    11.8357 
   H 143    5.1118    18.6873     6.9567    15.1779     4.8762     1.6199 
   H 144    2.0296    17.3794     7.3714    12.4357     1.0812     6.7908 
   H 145    2.3451    17.2705     7.7129    12.1286     1.5968     7.5782 
   H 146   10.3433     7.3713     9.1477     1.0812    11.1688    15.3846 
   H 147   10.8300     7.7129     9.8873     1.5968    11.6210    16.0289 
   H 148    6.4419    10.7305     1.1767     8.6048     7.3832     7.9031 
   H 149    6.9956    11.0076     1.6200     9.3123     7.8997     7.7289 
   H 150    6.3711    11.8323     1.1766     9.8364     7.2362     6.8625 
   H 151   16.6826     1.1767    12.8326     7.3832    17.6644    19.6718 
   H 152   16.7620     1.6200    12.6938     7.8997    17.7522    19.4801 
   H 153   15.8915     1.1767    11.8243     7.2363    16.8826    18.6213 
   H 154    7.0319    16.8425     5.4651    14.6072     7.3347     2.6113 
   H 155    7.9084    17.1858     6.0633    15.2219     8.2066     3.1229 
   H 156    7.9733    17.9879     6.7009    15.8468     8.1661     2.5469 
   H 157   12.0918     5.4651     7.2879     7.3347    13.0871    13.8309 
   H 158   12.4309     6.0633     7.4316     8.2066    13.4180    13.7639 
   H 159   11.6395     6.7009     6.5793     8.1661    12.6213    12.8880 
   H 160   11.9861     7.6930    11.0665     2.2901    12.7576    17.2330 
   H 161    2.6200    16.5212     7.6931    11.1706     2.2902     8.5127 
   H 162    9.4960     7.1101     7.8716     1.4158    10.3751    14.2479 
   H 163   10.0776     6.0966     7.8628     1.4158    10.9949    14.4675 
   H 164    2.2902    17.7819     7.1101    13.1688     1.4158     5.5105 
   H 165    1.8398    17.0166     6.0966    12.6559     1.4158     4.8399 
   H 166    3.1511    14.2102     6.6045     8.7727     3.5889     9.4104 
   H 167    2.4059    14.2457     5.9755     9.0411     2.9562     8.6302 
   H 168   14.2194     6.6045    12.7421     3.5889    15.0283    19.1971 
   H 169   13.7523     5.9754    12.0633     2.9561    14.5871    18.5883 
   H 170   14.3471     7.8083    13.3112     4.2100    15.1053    19.5843 
   H 171   13.2986     7.9808    12.4356     3.4849    14.0472    18.6079 
   H 172    4.0129    14.8931     7.8083     9.1830     4.2100    10.3004 
   H 173    3.5191    15.8049     7.9808    10.1989     3.4849     9.6992 
   H 174    6.7313    19.4161    11.7995    13.4759     6.1702    12.0046 
   H 175    8.9719    22.2468    14.2589    16.2793     8.2245    13.3855 
   H 176   10.9688    13.7461    12.8484     7.6079    11.3242    17.1941 
   H 177   10.8088    16.3773    13.8022    10.1305    10.9151    17.0888 
   H 178   14.5581    16.0142    16.5640    10.3788    14.8277    20.8273 
   H 179   14.5358    18.3998    17.3960    12.4621    14.6150    20.8088 
   H 180    7.0872    15.0246    10.3072     8.8210     7.2482    13.3757 
   H 181    7.5200    12.2194     9.1464     5.9916     8.0294    13.6145 
   H 182    4.4166    19.3728     9.7859    14.0563     3.5023     8.4729 
   H 183    7.2010    22.1450    12.5305    16.6782     6.2451    10.1987 

              C  79      C  80      C  81      C  82      C  83      C  84
              ------------------------------------------------------------------
   C  79    0.0000 
   C  80    7.1265     0.0000 
   C  81   11.0889    11.7696     0.0000 
   C  82    4.3992     9.8498     8.1063     0.0000 
   C  83    7.3752     8.1064    17.6481    11.7697     0.0000 
   C  84   10.5485    15.7267     8.7167     6.2450    17.8204     0.0000 
   C  85    2.5035     8.7167    13.4789     6.1222     6.2450    11.7696 
   C  86    9.7777    10.0384     1.7320     7.3205    16.0804     9.2001 
   C  87    8.0110     1.7320    13.5010    11.2092     7.3204    17.2262 
   C  88   10.7506    10.9304     1.0000     8.1228    17.0785     9.4007 
   C  89    7.9653     1.0000    12.6323    10.8322     8.1228    16.7264 
   C  90    8.9352     2.6457    14.3641    12.2052     7.5404    18.2259 
   C  91    9.5506     9.2044     2.6456     7.5404    15.5499    10.0017 
   H  92    4.7490     5.8790    14.7046     9.1164     2.9436    15.2974 
   H  93    8.1962    12.0071     5.1523     4.0131    15.5225     4.2029 
   H  94    6.1399     5.9082    15.7175    10.4795     2.2146    16.6824 
   H  95    6.8082    11.0646     5.9984     2.6009    14.1573     4.7100 
   H  96    8.4547    12.0566     4.8013     4.3318    15.7573     4.3800 
   H  97    4.5070     3.7368    12.9614     8.4356     4.9340    14.6746 
   H  98    4.8612     3.4477    13.0451     8.7278     5.0105    14.9592 
   H  99    8.1218    10.3943     3.2883     4.8212    15.0895     6.6200 
   H 100    7.6962     9.8657     3.5386     4.6017    14.6016     6.9516 
   H 101    6.3848     3.5387    14.3094    10.3051     4.6017    16.5344 
   H 102    6.1788     9.1243     5.0850     3.1671    13.2154     6.8637 
   H 103    5.8391     9.4591     5.7100     2.4267    13.0376     6.3409 
   H 104    6.8650     5.0851    15.6688    11.0664     3.1671    17.3086 
   H 105    6.6008     5.7101    15.8992    10.9018     2.4267    17.1234 
   H 106    3.1763     6.5035    13.7561     7.5751     4.2029    13.6852 
   H 107    8.5940    13.1304     6.5034     4.2029    15.9686     2.7431 
   H 108    3.0084     6.8302    13.7598     7.3924     4.3800    13.4585 
   H 109    8.7791    13.4543     6.8302     4.3800    16.1484     2.3716 
   H 110    1.9037     7.4851    12.9705     6.1363     5.7153    12.1061 
   H 111   11.0191    15.4534     7.1925     6.6200    18.3880     1.8397 
   H 112    5.5562     6.9855    15.8661     9.9551     1.8397    16.0488 
   H 113    6.2159    11.0864     6.9854     1.8397    13.5911     4.6695 
   H 114    6.1677     8.4880     4.9287     3.7025    12.9878     7.6290 
   H 115    7.1614     8.7459     3.9358     4.7222    13.8029     7.9731 
   H 116    7.5254     4.9288    15.9244    11.6527     3.7025    17.8975 
   H 117    7.5254     3.9359    15.2164    11.4512     4.7222    17.6761 
   H 118   11.1460    14.7058     5.3654     6.8637    18.4880     3.7220 
   H 119   10.5464    13.9270     4.7400     6.3410    17.8584     4.0761 
   H 120    1.7619     5.3654    10.8795     5.4284     6.8637    11.6728 
   H 121    2.4656     4.7400    11.3147     6.2085     6.3410    12.4497 
   H 122    9.7975    11.5315     1.8397     6.4419    16.6826     7.0318 
   H 123    5.7223     1.8398    12.2818     9.0408     6.4419    15.1568 
   H 124    3.7684     3.7218    12.0148     7.5000     5.7415    13.7271 
   H 125    9.7160    12.6648     3.7217     5.7415    16.9331     5.0104 
   H 126    6.8490     6.5411    16.5305    11.2163     1.5968    17.3974 
   H 127    7.4826     7.2717    17.3163    11.8714     1.0812    18.0194 
   H 128    5.2095     9.4531     6.5410     1.5968    12.5038     6.2747 
   H 129    4.4401     9.1075     7.2716     1.0812    11.7669     6.7003 
   H 130    6.2775     0.8744    11.2741     8.9924     7.8575    14.9111 
   H 131   11.1252    12.3074     0.8744     7.8575    17.8793     7.9483 
   H 132    0.6200     7.5002    11.6652     4.7354     7.0582    10.7797 
   H 133    0.6200     7.6420    10.8696     3.8717     7.9032     9.9695 
   H 134    0.6201     6.7889    10.5175     4.1291     7.7291    10.3492 
   H 135   11.4570    15.9209     7.5000     7.0581    18.8218     1.8849 
   H 136   12.3020    16.6042     7.6420     7.9032    19.6719     2.6113 
   H 137   12.1060    16.0812     6.7888     7.7289    19.4801     3.1229 
   H 138    1.2563     8.1741    12.0662     4.7962     7.1725    10.6586 
   H 139   11.5544    16.2815     8.1741     7.1725    18.8928     1.4158 
   H 140    8.3282    13.4722     7.7115     3.9755    15.6544     2.2900 
   H 141    3.6973     7.7115    14.6452     7.9750     3.9755    13.8954 
   H 142    1.6200     5.6979    10.1775     4.7010     7.6291    10.9375 
   H 143   11.9253    15.4402     5.6979     7.6291    19.2707     3.9611 
   H 144   11.5148    12.3776     0.6200     8.3641    18.1659     8.5163 
   H 145   11.6182    12.0117     0.6200     8.7125    18.0838     9.2547 
   H 146    6.7908     0.6200    11.1630     9.3256     8.3641    15.1518 
   H 147    7.5783     0.6199    11.5558    10.0916     8.7125    15.8627 
   H 148    3.8717     9.2427     8.1579     0.6200    11.2463     6.8484 
   H 149    4.1292     9.9899     8.7257     0.6200    11.4570     6.4221 
   H 150    4.9481    10.4584     8.1020     0.6200    12.3020     5.6451 
   H 151    7.9032     8.1580    18.0201    12.3020     0.6200    18.3820 
   H 152    7.7290     8.7258    18.1529    12.1060     0.6200    18.0958 
   H 153    6.8625     8.1022    17.2904    11.2463     0.6201    17.2628 
   H 154    9.9695    15.1070     8.3248     5.6451    17.2628     0.6200 
   H 155   10.3493    15.7559     9.1950     6.1257    17.5626     0.6200 
   H 156   11.1319    16.3465     9.1340     6.8485    18.3821     0.6201 
   H 157    2.6112     8.3248    13.6906     6.5406     5.6452    12.3019 
   H 158    3.1229     9.1950    14.0675     6.6071     6.1257    12.1060 
   H 159    2.5468     9.1340    13.2928     5.7404     6.8486    11.2462 
   H 160    8.5127     1.4157    12.6559    11.2429     8.6864    17.0583 
   H 161   11.1805    10.9948     1.4158     8.6865    17.3654     9.9998 
   H 162    5.5106     1.8398    10.4727     8.0103     8.0680    13.9110 
   H 163    4.8400     2.2902    11.1706     7.8663     7.0399    13.9446 
   H 164   11.6094    13.1963     1.8398     8.0680    18.5222     7.3757 
   H 165   10.7048    12.7576     2.2902     7.0399    17.7283     6.4878 
   H 166    9.2540     8.6075     3.2656     7.5273    15.0766    10.3700 
   H 167    8.9714     8.9583     2.8113     6.9246    15.0837     9.5736 
   H 168    9.4105     3.2657    14.9763    12.7697     7.5273    18.8145 
   H 169    8.6302     2.8113    14.5809    12.0595     6.9245    18.1432 
   H 170   10.3005     3.6199    14.9734    13.4182     8.7274    19.3455 
   H 171    9.6993     2.7430    13.9053    12.5928     8.9423    18.4362 
   H 172   10.2812     8.8911     3.6199     8.7274    15.7904    11.4160 
   H 173   10.9063     9.9368     2.7430     8.9423    16.6854    11.0107 
   H 174   14.8540    13.0232     5.1702    12.7836    20.3351    13.8244 
   H 175   17.5939    15.7973     7.2690    15.2561    23.1665    15.4778 
   H 176   12.5810     6.6823    10.7547    13.4622    14.7458    17.8979 
   H 177   14.4402     9.2702    10.1540    14.5564    17.3765    18.1691 
   H 178   15.9574     9.3823    14.1712    17.1536    16.9903    21.6088 
   H 179   17.5417    11.4955    13.8239    18.1037    19.3910    21.8988 
   H 180   11.7125     8.2209     6.5548    11.1308    15.9917    14.4407 
   H 181    9.4754     5.3978     7.6396     9.8017    13.1934    14.1983 
   H 182   13.7878    13.8582     2.7186    10.7807    20.2015    10.5037 
   H 183   16.6185    16.4062     5.5374    13.5172    22.9878    12.4875 

              C  85      C  86      C  87      C  88      C  89      C  90
              ------------------------------------------------------------------
   C  85    0.0000 
   C  86   12.2306     0.0000 
   C  87    9.2000    11.7696     0.0000 
   C  88   13.1918     0.9999    12.6581     0.0000 
   C  89    9.4007    10.9005     0.9999    11.7697     0.0000 
   C  90   10.0017    12.6323     1.0001    13.5010     1.7320     0.0000 
   C  91   12.0387     1.0000    10.9305     1.7320    10.0385    11.7697 
   H  92    4.4187    13.1402     5.6352    14.1388     6.1882     6.2039 
   H  93   10.1224     5.1926    13.6139     5.5993    13.0010    14.6012 
   H  94    5.7745    14.1047     5.2500    15.0969     5.9860     5.6115 
   H  95    8.7066     5.6444    12.6118     6.2493    12.0644    13.6081 
   H  96   10.4244     4.9119    13.6817     5.2781    13.0468    14.6644 
   H  97    5.3371    11.3277     3.8777    12.3158     4.2065     4.6657 
   H  98    5.7153    11.3946     3.5074    12.3774     3.8679     4.2868 
   H  99   10.4033     2.8297    12.0826     3.4262    11.3586    13.0371 
   H 100   10.0155     2.8074    11.5518     3.5311    10.8319    12.5077 
   H 101    6.9516    12.6241     2.8074    13.5889     3.5311     3.2907 
   H 102    8.4664     4.1575    10.7440     4.9904    10.1168    11.7273 
   H 103    8.0158     4.9022    11.0297     5.6963    10.4580    12.0229 
   H 104    6.8637    14.0066     4.1574    14.9836     4.9904     4.3967 
   H 105    6.3409    14.2638     4.9021    15.2505     5.6963     5.1841 
   H 106    2.7431    12.2828     6.6846    13.2807     7.0350     7.4082 
   H 107   10.2378     6.6847    14.6816     7.0350    14.1299    15.6779 
   H 108    2.3716    12.3137     7.0497    13.3093     7.3828     7.7816 
   H 109   10.3522     7.0498    14.9940     7.3828    14.4542    15.9914 
   H 110    1.2347    11.6219     7.9757    12.6034     8.1662     8.7905 
   H 111   12.5553     7.9082    17.0402     7.9665    16.4497    18.0320 
   H 112    4.6695    14.3222     6.5530    15.3218     7.2021     7.0012 
   H 113    7.9430     6.5531    12.5621     7.2021    12.0844    13.5622 
   H 114    8.5517     3.7732    10.1363     4.6840     9.4734    11.1105 
   H 115    9.5784     2.7009    10.4426     3.6247     9.7051    11.3906 
   H 116    7.6291    14.2400     3.7731    15.2048     4.6840     3.8581 
   H 117    7.9732    13.5126     2.7009    14.4616     3.6247     2.8183 
   H 118   12.9808     6.2822    16.3613     6.2058    15.6856    17.3340 
   H 119   12.4613     5.5457    15.5885     5.5316    14.9045    16.5585 
   H 120    3.7220     9.3962     6.2821    10.3942     6.2058     7.2243 
   H 121    4.0761     9.7753     5.5456    10.7752     5.5316     6.4719 
   H 122   12.0918     2.2901    13.2510     2.3716    12.4606    14.1732 
   H 123    7.0317    10.5806     2.2900    11.5340     2.3716     3.2379 
   H 124    5.0104    10.3990     4.2882    11.3917     4.3949     5.1820 
   H 125   11.7824     4.2883    14.3418     4.3949    13.6349    15.3037 
   H 126    6.2747    14.9160     5.7242    15.9077     6.5291     5.9674 
   H 127    6.7004    15.7065     6.3613    16.6989     7.2058     6.5202 
   H 128    7.2885     5.7242    10.9588     6.5291    10.4525    11.9578 
   H 129    6.4916     6.3614    10.5494     7.2058    10.1017    11.5494 
   H 130    7.9482     9.5505     2.3715    10.4727     1.8398     3.3533 
   H 131   13.4557     2.3716    14.0387     1.8398    13.1963    14.9250 
   H 132    1.8847    10.3751     8.2806    11.3441     8.3013     9.1777 
   H 133    2.6112     9.6253     8.5820    10.5829     8.5029     9.5159 
   H 134    3.1229     9.1832     7.7816    10.1602     7.6648     8.7301 
   H 135   12.9596     8.2806    17.5084     8.3012    16.9170    18.5002 
   H 136   13.8309     8.5821    18.2128     8.5029    17.5969    19.2004 
   H 137   13.7638     7.7816    17.7150     7.6647    17.0679    18.6958 
   H 138    1.4157    10.8342     8.9081    11.7903     8.9600     9.7888 
   H 139   12.9403     8.9082    17.8432     8.9600    17.2802    18.8387 
   H 140    9.7187     7.7964    14.9523     8.2049    14.4709    15.9523 
   H 141    2.2901    13.2305     7.7963    14.2228     8.2049     8.4639 
   H 142    3.9610     8.7304     6.7718     9.7248     6.5959     7.7394 
   H 143   13.7404     6.7719    17.1040     6.5959    16.4162    18.0731 
   H 144   13.8753     2.3450    14.1093     1.5967    13.2447    14.9763 
   H 145   14.0258     2.0295    13.7394     1.0813    12.8498    14.5810 
   H 146    8.5162     9.4326     2.3450    10.3309     1.5968     3.2657 
   H 147    9.2547     9.8243     2.0295    10.6898     1.0813     2.8113 
   H 148    5.7404     7.2504    10.5922     8.0981    10.2227    11.5877 
   H 149    5.6638     7.9335    11.2851     8.7410    10.9597    12.2748 
   H 150    6.5406     7.4417    11.8266     8.1945    11.4427    12.8229 
   H 151    6.8485    16.4313     7.2503    17.4271     8.0981     7.3889 
   H 152    6.4222    16.6005     7.9335    17.5996     8.7410     8.1369 
   H 153    5.6451    15.7461     7.4417    16.7456     8.1946     7.7387 
   H 154   11.2462     8.7237    16.6064     8.9697    16.1066    17.6062 
   H 155   11.4569     9.5986    17.2217     9.8458    16.7539    18.2217 
   H 156   12.3020     9.6928    17.8461     9.8520    17.3462    18.8458 
   H 157    0.6200    12.3887     8.7236    13.3617     8.9696     9.5003 
   H 158    0.6201    12.8346     9.5985    13.7927     9.8458    10.3695 
   H 159    0.6201    12.1023     9.6927    13.0492     9.8520    10.5158 
   H 160    9.9997    10.9278     1.4157    11.7687     0.6200     1.8396 
   H 161   13.6401     1.4157    12.7137     0.6201    11.8032    13.5303 
   H 162    7.3757     8.7626     3.3533     9.7081     2.8294     4.3434 
   H 163    6.4877     9.4883     3.3533    10.4572     3.1409     4.3434 
   H 164   13.8685     3.3534    14.9250     2.8294    14.1001    15.8249 
   H 165   12.9143     3.3533    14.4745     3.1409    13.6904    15.4007 
   H 166   11.7531     1.5967    10.3309     2.3450     9.4326    11.1630 
   H 167   11.4532     1.0813    10.6898     2.0295     9.8243    11.5558 
   H 168   10.3700    13.2447     1.5968    14.1094     2.3450     0.6200 
   H 169    9.5735    12.8498     1.0813    13.7394     2.0295     0.6201 
   H 170   11.4159    13.2511     2.2901    14.0682     2.6199     1.4157 
   H 171   11.0107    12.1846     1.8397    12.9972     1.7732     1.4158 
   H 172   12.7847     2.2900    10.5805     2.6199     9.6365    11.3471 
   H 173   13.4025     1.8396    11.6342     1.7732    10.6963    12.4107 
   H 174   17.3540     5.4654    14.6116     4.7572    13.6219    15.2462 
   H 175   20.0861     7.9836    17.3554     7.1335    16.3602    17.9529 
   H 176   14.7139     9.3412     7.5500     9.7558     6.6495     7.7177 
   H 177   16.7369     9.0806    10.2978     9.2067     9.3620    10.5239 
   H 178   17.9254    12.8823     9.6909    13.1861     9.0070     9.4873 
   H 179   19.6921    12.8058    12.0744    12.8955    11.2869    12.0015 
   H 180   14.1537     5.3650     9.7033     5.5758     8.7039    10.2629 
   H 181   11.8127     6.0350     6.9245     6.6588     5.9298     7.5480 
   H 182   16.1914     4.1224    15.5694     3.1233    14.6446    16.3652 
   H 183   19.0162     6.9300    18.0910     5.9308    17.1385    18.8373 

              C  91      H  92      H  93      H  94      H  95      H  96
              ------------------------------------------------------------------
   C  91    0.0000 
   H  92   12.6233     0.0000 
   H  93    5.8965    12.7246     0.0000 
   H  94   13.5211     1.4158    14.0090     0.0000 
   H  95    6.1589    11.3898     1.4158    12.6968     0.0000 
   H  96    5.6509    12.9403     0.3799    14.2102     1.7320     0.0000 
   H  97   10.7238     2.2400    11.6249     2.8059    10.3908    11.7886 
   H  98   10.7639     2.4522    11.8485     2.8315    10.6337    12.0032 
   H  99    3.4544    12.1754     2.4522    13.3305     2.8315     2.2400 
   H 100    3.2907    11.6813     2.7502    12.8243     2.8717     2.5939 
   H 101   11.9275     2.9163    13.3754     2.4581    12.1823    13.5186 
   H 102    4.3967    10.3223     2.8867    11.5208     2.2128     2.9378 
   H 103    5.1841    10.1877     2.6367    11.4378     1.6309     2.7883 
   H 104   13.3485     2.4530    14.3905     1.3134    13.1329    14.5626 
   H 105   13.6474     1.9444    14.3607     0.5869    13.0675    14.5512 
   H 106   11.8750     1.7320    11.3282     3.1407     9.9570    11.5700 
   H 107    7.4082    13.2760     1.5143    14.6146     2.0699     1.7732 
   H 108   11.9345     2.0699    11.1964     3.4641     9.8141    11.4473 
   H 109    7.7816    13.4830     1.8915    14.8316     2.3902     2.1385 
   H 110   11.3437     3.4641    10.0370     4.8708     8.6345    10.3091 
   H 111    8.7905    15.7190     3.4641    17.0629     4.4726     3.4849 
   H 112   13.8257     1.2347    13.6851     1.4674    12.3231    13.9184 
   H 113    7.0012    10.8984     2.2901    12.2423     1.0000     2.6457 
   H 114    3.8581    10.0658     3.5823    11.2103     2.9968     3.5861 
   H 115    2.8183    10.8648     3.7834    11.9500     3.5872     3.6778 
   H 116   13.5417     3.2291    14.8737     2.0754    13.6454    15.0313 
   H 117   12.7746     3.7291    14.4728     2.8626    13.2981    14.6069 
   H 118    7.2243    15.6948     2.9702    16.9763     4.3378     2.7752 
   H 119    6.4719    15.0401     2.3529    16.3045     3.7617     2.1014 
   H 120    8.9980     3.9640     8.8033     5.2069     7.5042     9.0034 
   H 121    9.3080     3.4018     9.4969     4.5535     8.2236     9.6828 
   H 122    3.2379    13.7541     3.3143    14.8685     4.1967     2.9677 
   H 123    9.8559     4.0552    11.7278     4.2273    10.6298    11.8343 
   H 124    9.8262     2.8736    10.6296     3.7058     9.4042    10.7908 
   H 125    5.1820    14.0691     1.8396    15.2934     3.1644     1.4674 
   H 126   14.3277     2.1012    14.7890     0.8135    13.4675    14.9952 
   H 127   15.1225     2.7751    15.4989     1.6022    14.1647    15.7125 
   H 128    5.9674     9.7020     3.0231    10.9930     1.7254     3.2552 
   H 129    6.5202     8.9950     3.7600    10.3076     2.3955     4.0148 
   H 130    8.7626     5.4176    11.2480     5.6429    10.2684    11.3119 
   H 131    3.3533    14.9397     4.5910    16.0050     5.5836     4.2229 
   H 132   10.1614     4.5748     8.6228     5.9866     7.2207     8.8954 
   H 133    9.4603     5.3360     7.7460     6.7348     6.3442     8.0191 
   H 134    8.9411     4.9947     7.7954     6.3504     6.4290     8.0376 
   H 135    9.1776    16.1645     3.9278    17.5120     4.9387     3.9394 
   H 136    9.5159    16.9974     4.5992    18.3376     5.7078     4.5578 
   H 137    8.7300    16.7511     4.1398    18.0680     5.3739     4.0358 
   H 138   10.6676     4.8860     8.7680     6.3006     7.3542     9.0602 
   H 139    9.7888    16.2875     4.3589    17.6516     5.2330     4.4187 
   H 140    8.4639    13.0705     2.6111    14.4445     2.5910     2.9280 
   H 141   12.8783     2.3800    11.8715     3.6055    10.4714    12.1397 
   H 142    8.3792     4.7424     8.0194     5.9914     6.7250     8.2189 
   H 143    7.7394    16.4792     3.7546    17.7607     5.1175     3.5569 
   H 144    3.2656    15.2230     5.1715    16.2564     6.1370     4.8052 
   H 145    2.8113    15.1413     5.7609    16.1247     6.6184     5.4065 
   H 146    8.6075     5.9816    11.4049     6.1513    10.4791    11.4499 
   H 147    8.9584     6.4980    12.0598     6.5190    11.1748    12.0899 
   H 148    7.3889     8.5563     4.3935     9.9087     2.9814     4.6864 
   H 149    8.1369     8.8768     4.5380    10.2603     3.1408     4.8707 
   H 150    7.7387     9.6837     3.6981    11.0556     2.3258     4.0417 
   H 151   15.8735     3.3461    16.0180     2.3869    14.6623    16.2456 
   H 152   16.0872     3.4641    15.9086     2.8292    14.5319    16.1524 
   H 153   15.2446     2.6270    15.0362     2.2093    13.6618    15.2785 
   H 154    9.5003    14.7172     3.6531    16.0980     4.0977     3.8556 
   H 155   10.3695    15.0944     4.5048    16.4893     4.8399     4.7206 
   H 156   10.5158    15.8807     4.7700    17.2692     5.3242     4.9268 
   H 157   12.1483     3.8131    10.5154     5.1595     9.1018    10.8065 
   H 158   12.6519     4.5826    10.6179     5.8808     9.2029    10.9278 
   H 159   11.9603     5.0278     9.7530     6.3905     8.3389    10.0661 
   H 160   10.0374     6.8033    13.2644     6.5694    12.3747    13.2939 
   H 161    1.8396    14.4328     6.2193    15.3509     6.8590     5.8972 
   H 162    8.0221     5.4072    10.2607     5.8767     9.2702    10.3307 
   H 163    8.8091     4.3379    10.4931     4.8690     9.3996    10.6001 
   H 164    4.3434    15.5928     4.4599    16.7004     5.6323     4.0801 
   H 165    4.3434    14.8144     3.3863    15.9634     4.5710     3.0066 
   H 166    0.6200    12.1607     6.2145    13.0245     6.3482     5.9954 
   H 167    0.6200    12.1491     5.4236    13.0822     5.6034     5.2003 
   H 168   12.3777     6.4280    15.2100     5.7100    14.2072    15.2759 
   H 169   12.0118     5.6670    14.6019     5.0185    13.5654    14.6809 
   H 170   12.3411     7.5866    15.6086     6.9096    14.6838    15.6467 
   H 171   11.2710     7.4549    14.6418     6.9697    13.7544    14.6685 
   H 172    1.4157    12.9090     7.3094    13.6858     7.5227     7.0664 
   H 173    1.4158    13.7815     7.0321    14.6083     7.4450     6.7490 
   H 174    5.3638    17.4845    10.2981    18.1955    11.0065     9.9569 
   H 175    8.0490    20.3147    12.3759    21.0254    13.2658    12.0108 
   H 176    8.3529    12.5363    13.6992    12.5701    13.4000    13.5577 
   H 177    8.1924    15.0157    14.0039    15.1766    13.9903    13.7935 
   H 178   11.9165    15.1889    17.4069    14.9396    17.1310    17.2547 
   H 179   11.9241    17.3739    17.7278    17.2728    17.6770    17.5217 
   H 180    4.4616    13.3021    10.2860    13.7900    10.3363    10.0683 
   H 181    5.0395    10.5580    10.0098    10.9854     9.6699     9.8873 
   H 182    4.7285    17.2621     7.5194    18.2129     8.5470     7.1447 
   H 183    7.4523    20.0531    10.0406    20.9729    11.1827     9.6608 

              H  97      H  98      H  99      H 100      H 101      H 102
              ------------------------------------------------------------------
   H  97    0.0000 
   H  98    0.3800     0.0000 
   H  99   10.7118    10.8695     0.0000 
   H 100   10.1933    10.3472     0.5331     0.0000 
   H 101    1.8927     1.5776    12.2975    11.7697     0.0000 
   H 102    8.9822     9.1712     1.9444     1.5576    10.6553     0.0000 
   H 103    9.0006     9.2178     2.4530     2.1821    10.7400     0.7971 
   H 104    2.7883     2.6367    13.4959    12.9756     1.5576    11.7697 
   H 105    2.9379     2.8867    13.5979    13.0854     2.1821    11.8189 
   H 106    2.8315     3.1864    11.0170    10.5491     4.2498     9.1071 
   H 107   12.3952    12.6503     3.9665     4.2498    14.2088     4.1391 
   H 108    3.1864     3.5465    10.9659    10.5072     4.6297     9.0437 
   H 109   12.6503    12.9116     4.3433     4.6297    14.4747     4.4983 
   H 110    4.1252     4.5048    10.0253     9.5975     5.7980     8.0825 
   H 111   14.8428    15.0944     5.6083     6.0328    16.6489     6.3469 
   H 112    3.4457     3.6200    13.2627    12.7784     3.7503    11.3816 
   H 113   10.0745    10.3432     3.7759     3.7503    11.9118     2.7806 
   H 114    8.5940     8.7575     2.1215     1.6160    10.2020     0.7845 
   H 115    9.2612     9.3914     1.6616     1.1512    10.7722     1.5911 
   H 116    3.2546     3.0289    13.8745    13.3489     1.6160    12.1976 
   H 117    3.0432     2.7266    13.3235    12.7930     1.1512    11.7240 
   H 118   14.5633    14.7759     4.4027     4.9036    16.2860     5.6563 
   H 119   13.8552    14.0599     3.6063     4.1094    15.5594     4.9110 
   H 120    3.0176     3.3298     8.2259     7.7400     4.9036     6.3593 
   H 121    2.2280     2.5340     8.7902     8.2903     4.1094     6.9674 
   H 122   12.1945    12.3268     1.6890     2.1064    13.7020     3.6284 
   H 123    1.8987     1.6109    10.4411     9.9086     2.1064     8.9159 
   H 124    1.0000     1.2346     9.7187     9.2017     2.8073     7.9825 
   H 125   12.7693    12.9551     2.2901     2.8073    14.4271     3.7874 
   H 126    3.6063     3.6089    14.1382    13.6331     3.0167    12.3219 
   H 127    4.4027     4.4049    14.8968    14.3947     3.7338    13.0675 
   H 128    8.6655     8.9086     3.2724     3.0167    10.4590     1.5763 
   H 129    8.0600     8.3209     4.0288     3.7338     9.8857     2.2154 
   H 130    3.1977     2.9677     9.7222     9.1904     3.4404     8.3745 
   H 131   13.2832    13.3895     3.0779     3.4404    14.7057     4.9920 
   H 132    4.6332     5.0020     8.6602     8.2465     6.4725     6.7158 
   H 133    5.1218     5.4735     7.8225     7.4207     7.0023     5.8798 
   H 134    4.4642     4.7970     7.5957     7.1571     6.3568     5.6587 
   H 135   15.3036    15.5566     6.0388     6.4724    17.1123     6.8121 
   H 136   16.0948    16.3409     6.5375     7.0023    17.8899     7.4801 
   H 137   15.7466    15.9778     5.8701     6.3566    17.5111     6.9726 
   H 138    5.1927     5.5678     8.9887     8.5998     6.9923     7.0510 
   H 139   15.5160    15.7809     6.5813     6.9923    17.3459     7.2158 
   H 140   12.3918    12.6734     5.0104     5.2203    14.2478     4.8032 
   H 141    4.0017     4.3379    11.7824    11.3381     5.2203     9.8467 
   H 142    3.7371     4.0271     7.4663     6.9866     5.6046     5.5870 
   H 143   15.3431    15.5537     5.0918     5.6046    17.0605     6.4210 
   H 144   13.5115    13.6030     3.5546     3.8735    14.8842     5.4310 
   H 145   13.3528    13.4228     3.8993     4.1311    14.6519     5.6679 
   H 146    3.7723     3.5294     9.7759     9.2476     3.8734     8.5202 
   H 147    4.3461     4.0632    10.3471     9.8237     4.1311     9.1732 
   H 148    7.8270     8.1159     4.9027     4.6218     9.6928     3.1078 
   H 149    8.3442     8.6531     5.4399     5.2213    10.2292     3.7774 
   H 150    9.0458     9.3407     4.8187     4.6646    10.9183     3.3424 
   H 151    5.1843     5.2181    15.5215    15.0274     4.6218    13.6640 
   H 152    5.5188     5.6083    15.5463    15.0645     5.2213    13.6576 
   H 153    4.7520     4.8734    14.6710    14.1901     4.6647    12.7811 
   H 154   14.0687    14.3511     6.0910     6.4026    15.9256     6.2626 
   H 155   14.5585    14.8533     6.9508     7.2492    16.4307     7.0348 
   H 156   15.2816    15.5683     7.1637     7.5117    17.1441     7.4679 
   H 157    4.8477     5.2222    10.6740    10.2669     6.4026     8.7305 
   H 158    5.7217     6.0953    10.9711    10.5918     7.2492     9.0392 
   H 159    5.8514     6.2311    10.1633     9.7969     7.5117     8.2407 
   H 160    4.8250     4.4876    11.5379    11.0162     4.1114    10.3778 
   H 161   12.5568    12.6010     4.0314     4.1115    13.7659     5.5373 
   H 162    3.1801     3.0583     8.7843     8.2515     3.9382     7.3929 
   H 163    2.1221     2.0375     9.2308     8.6993     3.1391     7.6839 
   H 164   14.0136    14.1377     3.4882     3.9382    15.4914     5.4307 
   H 165   13.3239    13.4695     2.6392     3.1391    14.8688     4.5426 
   H 166   10.2218    10.2491     3.7630     3.5207    11.3813     4.4431 
   H 167   10.2951    10.3515     2.9715     2.7518    11.5601     3.7883 
   H 168    5.0547     4.6749    13.6561    13.1266     3.5207    12.3384 
   H 169    4.2580     3.8782    13.1238    12.5920     2.7517    11.7440 
   H 170    6.0792     5.7007    13.9088    13.3866     4.6705    12.7225 
   H 171    5.7071     5.3405    12.8921    12.3730     4.5794    11.7555 
   H 172   10.8819    10.8725     4.8631     4.6705    11.8944     5.6472 
   H 173   11.8025    11.8111     4.6551     4.5794    12.8803     5.7868 
   H 174   15.4055    15.3662     8.1812     8.2489    16.2675     9.6175 
   H 175   18.2366    18.1955    10.5047    10.6592    19.0801    12.1182 
   H 176   10.3342    10.0857    11.3498    10.9640    10.1446    11.1935 
   H 177   12.7816    12.5701    11.5571    11.2745    12.7931    11.8735 
   H 178   13.1142    12.8090    15.0337    14.6637    12.4877    14.9253 
   H 179   15.2116    14.9396    15.2838    14.9922    14.8165    15.5334 
   H 180   11.0998    10.9854     7.8356     7.5710    11.6470     8.2783 
   H 181    8.3348     8.1994     7.7126     7.2974     8.8170     7.4620 
   H 182   15.4261    15.4787     5.9632     6.2488    16.6560     7.8003 
   H 183   18.1761    18.2129     8.7258     9.0435    19.3392    10.6001 

              H 103      H 104      H 105      H 106      H 107      H 108
              ------------------------------------------------------------------
   H 103    0.0000 
   H 104   11.7744     0.0000 
   H 105   11.7697     0.7971     0.0000 
   H 106    8.8768     4.1391     3.6763     0.0000 
   H 107    3.6763    15.1121    15.0094    11.7697     0.0000 
   H 108    8.7819     4.4983     4.0117     0.3800    11.5938     0.0000 
   H 109    4.0117    15.3536    15.2354    11.9551     0.3800    11.7697 
   H 110    7.7334     5.8521     5.4083     1.7321    10.3343     1.4158 
   H 111    6.0118    17.5638    17.4606    14.1951     2.4522    14.0090 
   H 112   11.1981     2.7806     2.0284     2.3800    14.1489     2.5910 
   H 113    2.0284    12.7661    12.6444     9.3909     2.3800     9.2186 
   H 114    1.5162    11.3798    11.4764     8.9516     4.8954     8.9205 
   H 115    2.3870    12.0275    12.1800     9.8415     5.2387     9.8340 
   H 116   12.2450     0.7845     1.5162     4.8954    15.6477     5.2596 
   H 117   11.8361     1.5911     2.3870     5.2387    15.3324     5.6169 
   H 118    5.5635    17.3378    17.3228    14.2905     2.8867    14.1514 
   H 119    4.8694    16.6356    16.6391    13.6696     2.6368    13.5435 
   H 120    6.2349     5.6563     5.5635     2.8867     9.4603     2.9379 
   H 121    6.9003     4.9110     4.8694     2.6368    10.2028     2.7884 
   H 122    4.1263    14.9629    15.1087    12.6504     4.6935    12.6122 
   H 123    9.1011     3.6284     4.1263     4.6935    12.6916     5.0318 
   H 124    8.0032     3.7874     3.8988     2.8736    11.4171     3.1644 
   H 125    3.8988    15.5570    15.6013    12.7756     2.8736    12.6774 
   H 126   12.2277     1.5763     0.8347     3.7616    15.3692     4.0510 
   H 127   12.9542     2.2154     1.5763     4.3377    16.0432     4.5910 
   H 128    0.8347    11.4101    11.3546     8.3149     3.7616     8.1941 
   H 129    1.5763    10.7754    10.6869     7.5696     4.3377     7.4367 
   H 130    8.6750     4.9920     5.5287     5.8546    12.3372     6.1624 
   H 131    5.5287    16.0237    16.2151    13.9067     5.8546    13.8867 
   H 132    6.3375     6.8122     6.4802     2.9094     8.9375     2.6816 
   H 133    5.4768     7.4801     7.2042     3.7230     8.0745     3.5234 
   H 134    5.3660     6.9728     6.7763     3.5330     8.2826     3.4176 
   H 135    6.4801    18.0211    17.9128    14.6322     2.9093    14.4420 
   H 136    7.2042    18.8251    18.7312    15.4782     3.7230    15.2929 
   H 137    6.7761    18.5004    18.4415    15.2778     3.5329    15.1113 
   H 138    6.6083     7.2158     6.8224     3.1644     8.9655     2.8736 
   H 139    6.8224    18.2063    18.0685    14.7206     3.1644    14.5151 
   H 140    4.1891    15.0411    14.8741    11.4879     1.2346    11.2779 
   H 141    9.5347     4.8032     4.1891     1.2346    12.1708     1.0000 
   H 142    5.4511     6.4210     6.3446     3.5823     8.6912     3.5862 
   H 143    6.3446    18.1189    18.1064    15.0725     3.5823    14.9316 
   H 144    6.0060    16.2311    16.4483    14.2383     6.4416    14.2312 
   H 145    6.3089    16.0360    16.2897    14.2351     7.0943    14.2493 
   H 146    8.8682     5.4310     6.0060     6.4416    12.5423     6.7489 
   H 147    9.5551     5.6679     6.3089     7.0943    13.2314     7.4154 
   H 148    2.4516    10.4720    10.3218     7.0450     4.7270     6.8779 
   H 149    3.0447    10.9114    10.7044     7.2850     4.5826     7.0782 
   H 150    2.5565    11.6635    11.4859     8.1180     3.7086     7.9220 
   H 151   13.5104     3.1078     2.4516     4.7270    16.4957     4.9267 
   H 152   13.4539     3.7774     3.0447     4.5826    16.3089     4.7206 
   H 153   12.5776     3.3425     2.5566     3.7085    15.4485     3.8555 
   H 154    5.7282    16.7113    16.5343    13.1155     2.1650    12.8946 
   H 155    6.4598    17.1558    16.9436    13.4579     3.0000    13.2183 
   H 156    6.9550    17.9075    17.7146    14.2591     3.3363    14.0271 
   H 157    8.3239     6.2626     5.7282     2.1650    10.6961     1.7876 
   H 158    8.5687     7.0348     6.4598     3.0000    10.6741     2.6200 
   H 159    7.7451     7.4679     6.9550     3.3363     9.7973     2.9703 
   H 160   10.7567     5.5373     6.2605     7.6522    14.4330     7.9986 
   H 161    6.2606    15.1879    15.4833    13.6327     7.6523    13.6755 
   H 162    7.6799     5.4307     5.8603     5.5407    11.3393     5.8086 
   H 163    7.8668     4.5426     4.8992     4.5032    11.4632     4.7865 
   H 164    5.8603    16.7744    16.9339    14.4869     5.5407    14.4449 
   H 165    4.8992    16.1021    16.2225    13.6456     4.5032    13.5861 
   H 166    5.2399    12.8178    13.1353    11.4703     7.7285    11.5450 
   H 167    4.5789    12.9549    13.2276    11.3532     6.9379    11.4022 
   H 168   12.6265     4.4431     5.2399     7.7285    16.2771     8.1059 
   H 169   12.0005     3.7882     4.5788     6.9378    15.6340     7.3146 
   H 170   13.0756     5.6472     6.4439     8.8220    16.7487     9.1960 
   H 171   12.1367     5.7868     6.5665     8.5221    15.8129     8.8858 
   H 172    6.4439    13.3780    13.7524    12.3365     8.8220    12.4368 
   H 173    6.5665    14.3469    14.6966    13.1246     8.5221    13.2035 
   H 174   10.3676    17.7905    18.2213    16.9572    11.6731    17.0598 
   H 175   12.8298    20.6083    21.0470    19.7689    13.6263    19.8642 
   H 176   11.8854    11.6367    12.3250    12.9377    15.1652    13.2188 
   H 177   12.6376    14.3158    14.9732    15.2307    15.5155    15.4796 
   H 178   15.6169    13.8239    14.5858    15.8784    18.8815    16.1962 
   H 179   16.2841    16.2316    16.9668    17.8761    19.2378    18.1668 
   H 180    9.0614    13.2014    13.7252    13.1246    11.7994    13.3065 
   H 181    8.1546    10.3723    10.9053    10.5119    11.4593    10.7247 
   H 182    8.4072    18.0730    18.3574    16.3898     8.6921    16.4097 
   H 183   11.1786    20.7845    21.0979    19.2107    11.0514    19.2352 

              H 109      H 110      H 111      H 112      H 113      H 114
              ------------------------------------------------------------------
   H 109    0.0000 
   H 110   10.4908     0.0000 
   H 111    2.2400    12.7245     0.0000 
   H 112   14.3351     3.9755    16.5751     0.0000 
   H 113    2.5910     7.9750     4.8212    11.7697     0.0000 
   H 114    5.2596     8.0586     7.0447    11.1667     3.5393     0.0000 
   H 115    5.6169     9.0369     7.1491    11.9989     4.3083     1.0739 
   H 116   15.8997     6.5957    18.0963     3.5393    13.3195    11.7697 
   H 117   15.6027     6.8543    17.7682     4.3083    13.0460    11.2442 
   H 118    2.9379    12.9657     1.9444    16.6515     5.0385     6.2251 
   H 119    2.7884    12.3899     2.4530    16.0196     4.5519     5.4553 
   H 120    9.6980     2.6367    11.9125     5.0385     7.1098     6.1284 
   H 121   10.4487     2.8867    12.6540     4.5519     7.8654     6.6743 
   H 122    5.0318    11.7000     5.6457    14.8650     5.1927     3.7011 
   H 123   12.9854     5.7977    15.0958     5.1927    10.4886     8.3897 
   H 124   11.6774     3.7759    13.8622     4.1077     9.1085     7.5995 
   H 125    3.1644    11.5968     3.6200    15.0941     4.1077     4.2448 
   H 126   15.5797     5.4667    17.8144     1.6620    12.9933    12.0186 
   H 127   16.2450     5.9943    18.4829     2.0354    13.6642    12.7792 
   H 128    4.0510     7.0812     6.1909    10.6654     1.6620     2.1775 
   H 129    4.5910     6.2997     6.7887     9.9311     2.0354     2.6642 
   H 130   12.6554     6.7233    14.6814     6.5829    10.2598     7.7649 
   H 131    6.1624    13.0228     6.3757    16.0765     6.5829     4.9721 
   H 132    9.1027     1.4142    11.3400     5.2698     6.5715     6.7384 
   H 133    8.2466     2.2910    10.4856     6.0991     5.7040     5.9415 
   H 134    8.4884     2.4531    10.7244     5.8941     5.9041     5.6074 
   H 135    2.6815    13.1494     0.4683    17.0120     5.2698     7.5066 
   H 136    3.5234    14.0084     1.2842    17.8581     6.0991     8.1439 
   H 137    3.4174    13.8643     1.3894    17.6541     5.8940     7.5947 
   H 138    9.1038     1.4673    11.3282     5.4428     6.6325     7.1406 
   H 139    2.8736    13.1950     1.0000    17.0970     5.4428     7.9360 
   H 140    1.0000     9.9551     2.8736    13.8622     2.3902     5.5865 
   H 141   12.3231     1.8397    14.5542     2.3902     9.8141     9.7701 
   H 142    8.9342     3.0289    11.1430     5.7978     6.3496     5.3802 
   H 143    3.5862    13.7402     2.1215    17.4345     5.7978     6.9715 
   H 144    6.7489    13.4057     6.9205    16.3749     7.1346     5.3475 
   H 145    7.4154    13.4913     7.6888    16.3141     7.6053     5.4750 
   H 146   12.8693     7.2943    14.8550     7.1346    10.5222     7.8774 
   H 147   13.5641     8.0270    15.5184     7.6053    11.2508     8.5064 
   H 148    4.9267     5.6614     7.1636     9.4232     2.3470     3.5311 
   H 149    4.7206     5.7744     6.9507     9.6601     2.2901     4.2880 
   H 150    3.8556     6.6352     6.0910    10.4966     1.4245     3.9645 
   H 151   16.6820     6.2843    18.9220     2.3470    14.1163    13.4117 
   H 152   16.4778     6.0000    18.7151     2.2901    13.9364    13.4539 
   H 153   15.6212     5.1581    17.8596     1.4245    13.0740    12.5802 
   H 154    1.7876    11.5515     1.8333    15.4836     4.0511     7.0318 
   H 155    2.6200    11.8485     2.4522    15.8088     4.6695     7.8116 
   H 156    2.9703    12.6668     2.0438    16.6180     5.2883     8.2298 
   H 157   10.8244     0.9138    13.0400     4.0511     8.3743     8.7639 
   H 158   10.7729     1.7321    12.9581     4.6695     8.4107     9.1432 
   H 159    9.8962     1.7271    12.0829     5.2884     7.5381     8.3802 
   H 160   14.7644     8.7650    16.7229     7.8061    12.4374     9.7098 
   H 161    7.9987    13.0151     8.5405    15.6279     7.8062     5.1849 
   H 162   11.6565     6.1775    13.6886     6.6242     9.2607     6.7982 
   H 163   11.7598     5.2669    13.8636     5.5591     9.2752     7.1670 
   H 164    5.8086    13.5131     5.7039    16.7048     6.6242     5.5402 
   H 165    4.7865    12.6070     4.9103    15.9006     5.5591     4.7538 
   H 166    8.1059    11.0113     9.2282    13.3715     7.1385     3.8249 
   H 167    7.3147    10.7790     8.4365    13.3425     6.4235     3.2386 
   H 168   16.5884     9.1728    18.6370     7.1385    14.1482    11.7254 
   H 169   15.9389     8.3757    18.0118     6.4234    13.4740    11.1543 
   H 170   17.0737    10.2029    19.0616     8.3311    14.7002    12.0662 
   H 171   16.1442     9.7815    18.1013     8.3257    13.8108    11.0833 
   H 172    9.1960    11.9889    10.1829    14.1340     8.3311     5.0262 
   H 173    8.8858    12.6719     9.6577    14.9983     8.3257     5.2704 
   H 174   12.0002    16.5947    12.2026    18.7147    11.9564     9.1744 
   H 175   13.9180    19.3630    13.7322    21.5445    14.2490    11.7543 
   H 176   15.5432    13.5502    16.9496    13.6649    13.9043    10.4097 
   H 177   15.8943    15.6358    16.9791    16.1859    14.6539    11.1214 
   H 178   19.2602    16.7196    20.6159    16.2046    17.6344    14.1416 
   H 179   19.6170    18.5271    20.7087    18.4575    18.3090    14.7698 
   H 180   12.1774    13.1744    13.2511    14.5309    11.0506     7.5554 
   H 181   11.8359    10.7484    13.3202    11.7783    10.1756     6.6780 
   H 182    8.9700    15.6609     8.7749    18.4446     9.5462     7.6396 
   H 183   11.2840    18.4924    10.6693    21.2436    12.1808    10.4653 

              H 115      H 116      H 117      H 118      H 119      H 120
              ------------------------------------------------------------------
   H 115    0.0000 
   H 116   12.3662     0.0000 
   H 117   11.7697     1.0739     0.0000 
   H 118    6.0545    17.8044    17.3683     0.0000 
   H 119    5.2599    17.0887    16.6339     0.7971     0.0000 
   H 120    6.9792     6.2251     6.0545    11.7697    11.0987     0.0000 
   H 121    7.4631     5.4553     5.2599    12.4556    11.7697     0.7971 
   H 122    2.9355    15.2991    14.6879     3.9929     3.2576     9.8278 
   H 123    8.8629     3.7011     2.9355    14.5722    13.8217     3.9929 
   H 124    8.2821     4.2448     3.9513    13.5652    12.8559     2.1356 
   H 125    3.9513    15.9792    15.4817     2.1356     1.3414    10.1073 
   H 126   12.7626     2.1775     3.1517    17.7579    17.0916     5.9932 
   H 127   13.5361     2.6642     3.7111    18.4690    17.8115     6.7213 
   H 128    3.1517    11.9201    11.5773     5.9932     5.3552     5.7918 
   H 129    3.7111    11.3110    11.0167     6.7213     6.1074     5.1281 
   H 130    8.0898     4.9721     4.0776    13.9900    13.2178     4.5197 
   H 131    4.0776    16.3157    15.6480     4.5197     3.9242    11.0538 
   H 132    7.7448     7.5067     7.5948    11.5530    10.9757     2.1674 
   H 133    6.9675     8.1439     8.1439    10.6774    10.0990     2.3039 
   H 134    6.5845     7.5949     7.5067    10.7592    10.1368     1.5099 
   H 135    7.5947    18.5565    18.2326     2.1673     2.7698    12.3682 
   H 136    8.1439    19.3493    19.0039     2.3039     3.0449    13.1781 
   H 137    7.5065    18.9991    18.6115     1.5097     2.2921    12.8782 
   H 138    8.1725     7.9360     8.0954    11.6582    11.1153     2.8610 
   H 139    8.0954    18.7623    18.4752     2.8610     3.4355    12.5502 
   H 140    6.1028    15.6210    15.3884     3.8988     3.7875     9.3961 
   H 141   10.7114     5.5865     6.1028    14.8042    14.2243     3.8988 
   H 142    6.2593     6.9715     6.7519    10.9854    10.3142     0.7845 
   H 143    6.7519    18.5825    18.1397     0.7845     1.5162    12.5540 
   H 144    4.3975    16.4981    15.8014     5.0411     4.4746    11.3704 
   H 145    4.4568    16.2679    15.5334     5.8245     5.2377    11.3523 
   H 146    8.1266     5.3475     4.3975    14.0922    13.3123     5.0410 
   H 147    8.6885     5.4750     4.4568    14.6978    13.9124     5.8245 
   H 148    4.5891    11.0506    10.8379     7.3047     6.7430     4.8255 
   H 149    5.3207    11.5246    11.3795     7.3256     6.8382     5.3268 
   H 150    4.9303    12.2566    12.0652     6.4523     5.9764     6.0348 
   H 151   14.2025     3.5311     4.5891    18.9864    18.3470     7.3047 
   H 152   14.2890     4.2880     5.3207    18.8681    18.2516     7.3256 
   H 153   13.4200     3.9646     4.9304    17.9971    17.3781     6.4523 
   H 154    7.4037    17.2955    17.0663     3.5475     3.7892    11.0704 
   H 155    8.2293    17.7621    17.5769     4.3066     4.6161    11.5456 
   H 156    8.5497    18.5008    18.2867     3.9865     4.4319    12.2769 
   H 157    9.7683     7.0318     7.4037    13.4039    12.8630     3.5474 
   H 158   10.1757     7.8116     8.2293    13.4478    12.9470     4.3066 
   H 159    9.4256     8.2298     8.5497    12.5742    12.0780     3.9864 
   H 160    9.8778     5.1848     4.1144    15.8963    15.1097     6.7509 
   H 161    4.1144    15.3797    14.6060     6.7510     6.0966    10.7475 
   H 162    7.1670     5.5402     4.7538    13.0217    12.2535     3.7845 
   H 163    7.6696     4.7538     4.1001    13.3402    12.5916     3.0781 
   H 164    4.7538    17.0945    16.4585     3.7845     3.2997    11.6675 
   H 165    4.1001    16.4585    15.8697     3.0781     2.4578    10.8646 
   H 166    2.8538    12.9933    12.2104     7.7210     6.9556     8.6076 
   H 167    2.2042    13.1760    12.4391     6.9528     6.1813     8.4700 
   H 168   12.0102     3.8249     2.8538    17.9496    17.1748     7.7210 
   H 169   11.4906     3.2386     2.2042    17.3779    16.6096     6.9527 
   H 170   12.2490     5.0262     4.0572    18.2627    17.4773     8.5718 
   H 171   11.2308     5.2704     4.2217    17.2603    16.4721     7.9458 
   H 172    4.0572    13.4901    12.6465     8.5718     7.8349     9.5119 
   H 173    4.2217    14.4833    13.6589     7.9458     7.2476    10.2667 
   H 174    8.1060    17.8273    16.9147    10.2888     9.7711    14.1345 
   H 175   10.6806    20.6314    19.7058    11.7883    11.4145    16.9332 
   H 176    9.9266    11.3190    10.2494    15.5299    14.7557    11.0098 
   H 177   10.4036    14.0460    12.9844    15.3496    14.6245    13.0190 
   H 178   13.6438    13.3401    12.2834    19.1362    18.3737    14.2985 
   H 179   14.0957    15.8103    14.7398    19.0647    18.3460    15.9863 
   H 180    6.7558    13.1329    12.1566    11.6455    10.9102    10.5492 
   H 181    6.2272    10.3024     9.3315    12.0008    11.2127     8.1144 
   H 182    6.6265    18.2700    17.4956     6.8310     6.4366    13.5046 
   H 183    9.4574    20.9475    20.1363     8.7710     8.5679    16.3244 

              H 121      H 122      H 123      H 124      H 125      H 126
              ------------------------------------------------------------------
   H 121    0.0000 
   H 122   10.3554     0.0000 
   H 123    3.2576    11.7697     0.0000 
   H 124    1.3414    11.2126     2.0375     0.0000 
   H 125   10.7413     2.0375    12.6345    11.7697     0.0000 
   H 126    5.3552    15.6798     4.9311     4.5177    16.0905     0.0000 
   H 127    6.1074    16.4486     5.7017     5.3074    16.8276     0.7971 
   H 128    6.5027     4.9311     8.9345     7.6789     4.5177    11.7697 
   H 129    5.8653     5.7017     8.4566     7.0865     5.3074    11.0750 
   H 130    3.9242    10.9277     1.4158     3.0065    11.9751     6.3402 
   H 131   11.5386     1.4158    12.7140    12.3178     3.0065    16.8183 
   H 132    2.7699    10.3419     6.0052     3.9968    10.1892     6.6555 
   H 133    3.0449     9.5082     6.2920     4.3643     9.3175     7.4323 
   H 134    2.2923     9.2624     5.4950     3.6327     9.2600     7.0917 
   H 135   13.1121     6.0051    15.5634    14.3240     3.9967    18.2611 
   H 136   13.9142     6.2920    16.3041    15.1105     4.3643    19.0916 
   H 137   13.5942     5.4949    15.8633    14.7544     3.6326    18.8350 
   H 138    3.4355    10.6770     6.6447     4.6200    10.3992     6.9208 
   H 139   13.3081     6.6447    15.8543    14.5463     4.6200    18.3880 
   H 140   10.1691     5.8882    12.8701    11.4406     4.1077    15.1717 
   H 141    3.7875    13.4445     5.8882     4.1077    13.4130     4.0244 
   H 142    1.5162     9.0814     4.5044     2.8024     9.3268     6.7775 
   H 143   13.2388     4.5044    15.3349    14.3446     2.8024    18.5424 
   H 144   11.8269     1.9445    12.8661    12.5578     3.5914    17.0698 
   H 145   11.7628     2.4531    12.6035    12.4190     4.2840    16.9366 
   H 146    4.4745    10.9122     1.9445     3.5913    12.0477     6.8269 
   H 147    5.2377    11.4121     2.4531     4.2840    12.6304     7.1415 
   H 148    5.6013     6.5654     8.4210     6.8866     6.0474    10.6535 
   H 149    6.1198     7.0552     9.0757     7.4388     6.3006    10.9775 
   H 150    6.8180     6.3765     9.6607     8.1144     5.4888    11.7848 
   H 151    6.7430    17.0982     6.5654     6.0474    17.4002     1.6344 
   H 152    6.8382    17.1532     7.0552     6.3006    17.3525     2.2128 
   H 153    5.9764    16.2801     6.3765     5.4888    16.4761     1.7880 
   H 154   11.8451     6.5982    14.5392    13.1184     4.6037    16.8180 
   H 155   12.3305     7.4742    15.1162    13.6257     5.4752    17.1904 
   H 156   13.0558     7.4917    15.7746    14.3368     5.4576    17.9796 
   H 157    3.7891    12.3585     6.5981     4.6036    12.1385     5.6548 
   H 158    4.6161    12.6601     7.4742     5.4752    12.3023     6.3134 
   H 159    4.4319    11.8516     7.4917     5.4575    11.4488     6.8948 
   H 160    6.0965    12.5741     2.9788     4.9901    13.8235     7.0902 
   H 161   11.0942     2.9789    11.6914    11.6518     4.9902    16.1587 
   H 162    3.2997    10.0371     1.8398     2.6824    11.0231     6.6313 
   H 163    2.4578    10.5891     1.2348     1.6307    11.4113     5.6428 
   H 164   12.1933     1.8398    13.5306    13.0358     2.6824    17.5123 
   H 165   11.4274     1.2348    12.9603    12.3350     1.6307    16.7721 
   H 166    8.8790     3.7599     9.3003     9.3413     5.6441    13.8280 
   H 167    8.8084     3.0231     9.5090     9.3791     4.8621    13.8917 
   H 168    6.9556    14.7929     3.7599     5.6441    15.9217     5.9865 
   H 169    6.1812    14.3146     3.0231     4.8620    15.3740     5.3555 
   H 170    7.8349    14.9380     4.5800     6.5662    16.1937     7.1906 
   H 171    7.2476    13.8926     4.0130     6.0483    15.1801     7.3618 
   H 172    9.7142     4.5800     9.7908    10.0520     6.5662    14.4777 
   H 173   10.5250     4.0130    10.7821    10.9443     6.0483    15.4066 
   H 174   14.3311     6.9898    14.1656    14.6153     8.8743    18.9737 
   H 175   17.1476     9.0945    16.9812    17.4462    10.7551    21.8022 
   H 176   10.6653    11.5768     8.4820    10.0641    13.4283    13.1597 
   H 177   12.7961    11.3669    10.9988    12.3847    13.3630    15.8065 
   H 178   13.8502    15.1544    11.2157    13.0462    17.0593    15.3991 
   H 179   15.6415    15.0889    13.3288    15.0045    17.0912    17.7942 
   H 180   10.5206     7.6549     9.5994    10.4636     9.6379    14.5228 
   H 181    7.9705     8.1394     6.7791     7.7606     9.8729    11.7082 
   H 182   13.8968     4.3641    14.5821    14.5089     5.8198    19.0227 
   H 183   16.7016     7.0754    17.2482    17.2753     8.2434    21.7799 

              H 127      H 128      H 129      H 130      H 131      H 132
              ------------------------------------------------------------------
   H 127    0.0000 
   H 128   12.4766     0.0000 
   H 129   11.7697     0.7971     0.0000 
   H 130    7.1050     8.6366     8.2686     0.0000 
   H 131   17.5967     6.3402     7.1050    11.7697     0.0000 
   H 132    7.2471     5.6720     4.8879     6.6682    11.6822     0.0000 
   H 133    8.0507     4.7998     4.0135     6.7835    10.8604     0.8768 
   H 134    7.7607     4.7825     4.0379     5.9261    10.5751     1.2400 
   H 135   18.9261     6.6555     7.2471    15.1494     6.6681    11.7696 
   H 136   19.7629     7.4323     8.0507    15.8473     6.7835    12.6242 
   H 137   19.5243     7.0915     7.7606    15.3444     5.9260    12.4641 
   H 138    7.4603     5.8929     5.0971     7.3485    12.0400     0.6980 
   H 139   19.0364     6.9208     7.4603    15.4949     7.3485    11.8347 
   H 140   15.8105     4.0244     4.4138    12.6485     7.0804     8.5968 
   H 141    4.4138     8.9029     8.1267     7.0804    14.7422     3.2512 
   H 142    7.5038     5.0100     4.3552     4.8294    10.3258     2.1791 
   H 143   19.2535     6.7775     7.5038    14.7335     4.8294    12.3282 
   H 144   17.8531     6.8269     7.5799    11.8736     0.5870    12.0816 
   H 145   17.7258     7.1415     7.8645    11.5516     1.3135    12.2005 
   H 146    7.5799     8.8817     8.5574     0.5869    11.6943     7.2002 
   H 147    7.8645     9.6023     9.3031     1.3135    12.1269     7.9783 
   H 148   11.3193     1.6344     0.8924     8.3831     7.9739     4.2498 
   H 149   11.6092     2.2128     1.6309     9.1233     8.4710     4.3992 
   H 150   12.4298     1.7880     1.5200     9.6031     7.7889     5.2493 
   H 151    0.8924    12.9960    12.2685     7.9739    18.2741     7.6082 
   H 152    1.6309    12.8972    12.1489     8.4710    18.3666     7.3752 
   H 153    1.5201    12.0234    11.2770     7.7889    17.4975     6.5206 
   H 154   17.4464     5.6548     6.0832    14.2911     7.5829    10.2138 
   H 155   17.7956     6.3134     6.6727    14.9282     8.4459    10.5485 
   H 156   18.5954     6.8947     7.3180    15.5311     8.3438    11.3513 
   H 157    6.0832     7.6261     6.8324     7.5829    13.7045     2.0255 
   H 158    6.6727     7.8267     7.0299     8.4459    14.0308     2.5036 
   H 159    7.3181     6.9898     6.1942     8.3438    13.2314     1.9418 
   H 160    7.7498    10.7930    10.4773     2.2901    13.2512     8.8655 
   H 161   16.9528     7.0903     7.7499    10.5804     2.2902    11.7805 
   H 162    7.4198     7.6365     7.2727     1.0001    10.9305     5.9518 
   H 163    6.4372     7.7090     7.2472     1.4674    11.5704     5.2107 
   H 164   18.2830     6.6313     7.4198    12.6323     1.0001    12.1442 
   H 165   17.5330     5.6428     6.4372    12.1443     1.4674    11.2234 
   H 166   14.6241     5.9865     6.4795     8.1827     3.9640     9.8698 
   H 167   14.6844     5.3555     5.9015     8.4698     3.4018     9.5795 
   H 168    6.4795    12.5504    12.1307     3.9640    15.5410     9.6274 
   H 169    5.9014    11.8925    11.4487     3.4017    15.1148     8.8383 
   H 170    7.6753    13.0712    12.7105     4.4422    15.5890    10.5625 
   H 171    7.9300    12.1688    11.8433     3.6055    14.5264    10.0104 
   H 172   15.2746     7.1906     7.6753     8.5732     4.4422    10.9002 
   H 173   16.2036     7.3618     7.9300     9.5935     3.6055    11.5207 
   H 174   19.7680    11.1882    11.8087    12.8560     5.8810    15.4703 
   H 175   22.5960    13.6626    14.3321    15.6594     7.7897    18.2067 
   H 176   13.8517    12.3386    12.4268     7.1384    11.5823    13.1143 
   H 177   16.5229    13.2311    13.4803     9.6034    11.0261    15.0157 
   H 178   15.9945    16.0617    16.1296    10.0397    15.0258    16.4516 
   H 179   18.4336    16.8415    17.0380    12.0374    14.6981    18.0825 
   H 180   15.2995     9.7131    10.0500     8.2102     7.4143    12.3216 
   H 181   12.4809     8.6232     8.7489     5.3829     8.3896    10.0585 
   H 182   19.8151     9.2334     9.9762    13.4632     2.9634    14.3694 
   H 183   22.5745    11.9962    12.7535    16.0736     5.6602    17.1987 

              H 133      H 134      H 135      H 136      H 137      H 138
              ------------------------------------------------------------------
   H 133    0.0000 
   H 134    0.8768     0.0000 
   H 135   10.9186    11.1699     0.0000 
   H 136   11.7697    12.0032     0.8768     0.0000 
   H 137   11.5978    11.7695     1.2399     0.8769     0.0000 
   H 138    1.2096     1.8543    11.7458    12.6102    12.4983     0.0000 
   H 139   10.9981    11.3012     0.6981     1.2096     1.8543    11.7697 
   H 140    7.7648     8.0981     3.2512     4.1273     4.1879     8.5314 
   H 141    4.1273     4.1880    14.9762    15.8375    15.7018     3.2400 
   H 142    2.0033     1.1266    11.6001    12.4058    12.0986     2.8626 
   H 143   11.4530    11.5417     2.1790     2.0033     1.1265    12.4251 
   H 144   11.2717    10.9536     7.2002     7.2806     6.4152    12.4601 
   H 145   11.4148    11.0399     7.9782     8.0732     7.2093    12.6155 
   H 146    7.2805     6.4151    15.3222    16.0003    15.4717     7.8854 
   H 147    8.0732     7.2094    15.9845    16.6465    16.0972     8.6602 
   H 148    3.3758     3.5619     7.6082     8.4437     8.2343     4.3750 
   H 149    3.5620     3.9390     7.3751     8.2343     8.1147     4.3847 
   H 150    4.3992     4.7097     6.5206     7.3752     7.2414     5.2570 
   H 151    8.4437     8.2344    19.3587    20.2052    19.9993     7.7467 
   H 152    8.2343     8.1149    19.1437    19.9993    19.8301     7.4373 
   H 153    7.3751     7.2415    18.2902    19.1437    18.9669     6.6065 
   H 154    9.3958     9.7585     2.0256     2.8527     3.2098    10.1107 
   H 155    9.7585    10.1840     2.5036     3.2098     3.7424    10.3908 
   H 156   10.5485    10.9433     1.9419     2.5036     3.1577    11.2141 
   H 157    2.8526     3.2098    13.4511    14.3194    14.2276     1.7477 
   H 158    3.2098     3.7424    13.3535    14.2277    14.1896     2.0033 
   H 159    2.5036     3.1576    12.4795    13.3534    13.3128     1.3126 
   H 160    9.0390     8.1916    17.1890    17.8507    17.2991     9.5304 
   H 161   11.0368    10.5826     8.8655     9.0391     8.1916    12.2460 
   H 162    5.9779     5.1066    14.1568    14.8595    14.3652     6.6449 
   H 163    5.3660     4.5241    14.3313    15.0701    14.6286     5.8870 
   H 164   11.3012    11.0834     5.9517     5.9779     5.1065    12.4566 
   H 165   10.3697    10.1973     5.2106     5.3660     4.5240    11.5075 
   H 166    9.2001     8.6388     9.6273     9.9997     9.2302    10.4012 
   H 167    8.8676     8.3649     8.8383     9.2229     8.4626    10.0761 
   H 168    9.9997     9.2303    19.1052    19.8090    19.3084    10.2228 
   H 169    9.2228     8.4626    18.4801    19.1974    18.7165     9.4299 
   H 170   10.8720    10.0699    19.5285    20.2010    19.6594    11.1824 
   H 171   10.2482     9.4188    18.5671    19.2259    18.6691    10.6561 
   H 172   10.2652     9.6621    10.5624    10.8720    10.0698    11.4564 
   H 173   10.8382    10.2925    10.0103    10.2482     9.4187    12.0425 
   H 174   14.7982    14.2379    12.4561    12.4454    11.5688    16.0009 
   H 175   17.5089    16.9816    13.9091    13.7338    12.8705    18.7164 
   H 176   12.9146    12.0560    17.3693    17.7926    17.0396    13.8095 
   H 177   14.6864    13.8684    17.3589    17.6532    16.8372    15.6942 
   H 178   16.3448    15.4722    21.0273    21.4179    20.6440    17.1495 
   H 179   17.8575    17.0062    21.0861    21.3687    20.5464    18.7762 
   H 180   11.8469    11.1046    13.6346    13.9466    13.1410    12.9587 
   H 181    9.7099     8.8973    13.7513    14.2227    13.5048    10.7312 
   H 182   13.5809    13.2097     8.9732     8.8633     7.9893    14.7799 
   H 183   16.4067    16.0410    10.7699    10.4619     9.6335    17.6036 

              H 139      H 140      H 141      H 142      H 143      H 144
              ------------------------------------------------------------------
   H 139    0.0000 
   H 140    3.2400     0.0000 
   H 141   15.0087    11.7697     0.0000 
   H 142   11.7922     8.6551     4.5040     0.0000 
   H 143    2.8626     4.5040    15.5792    11.7697     0.0000 
   H 144    7.8855     7.6674    15.1030    10.6563     5.3051     0.0000 
   H 145    8.6602     8.3081    15.1464    10.6635     6.1010     0.7970 
   H 146   15.6893    12.9044     7.6673     5.3050    14.8250    11.7696 
   H 147   16.3676    13.6267     8.3081     6.1010    15.4203    12.1690 
   H 148    7.7467     4.5708     7.5006     4.0905     8.0787     8.4569 
   H 149    7.4373     4.2029     7.6036     4.6407     8.0800     8.9804 
   H 150    6.6065     3.3890     8.4683     5.3136     7.2048     8.3166 
   H 151   19.4405    16.2042     4.5708     8.0787    19.7700    18.5470 
   H 152   19.1951    15.9551     4.2029     8.0800    19.6491    18.6637 
   H 153   18.3496    15.1099     3.3890     7.2048    18.7785    17.7982 
   H 154    1.7478     1.6779    13.3501    10.3318     3.9034     8.1591 
   H 155    2.0033     2.2901    13.6175    10.8262     4.5732     9.0198 
   H 156    1.3127     2.9056    14.4469    11.5448     4.1126     8.9025 
   H 157   13.4511    10.2203     1.6779     3.9033    14.1695    14.1066 
   H 158   13.3082    10.1046     2.2901     4.5732    14.2011    14.4569 
   H 159   12.4394     9.2315     2.9056     4.1125    13.3263    13.6681 
   H 160   17.5711    14.8171     8.8243     7.1075    16.6161    13.2722 
   H 161    9.5305     8.8244    14.6028    10.0990     7.1076     1.9203 
   H 162   14.4980    11.6490     6.7748     3.9878    13.7697    11.0629 
   H 163   14.6268    11.6606     5.7377     3.4604    14.1040    11.7452 
   H 164    6.6449     6.7748    15.2691    10.9202     3.9878     1.3416 
   H 165    5.8870     5.7377    14.3849    10.1033     3.4604     2.0286 
   H 166   10.2228     8.7387    12.5012     8.0178     8.2625     3.8856 
   H 167    9.4300     7.9604    12.3372     7.8338     7.5120     3.4208 
   H 168   19.4391    16.5379     8.7387     8.2625    18.6897    15.5891 
   H 169   18.7982    15.8612     7.9603     7.5119    18.1257    15.1888 
   H 170   19.8971    17.0878     9.8683     9.0507    18.9849    15.5918 
   H 171   18.9508    16.1923     9.6357     8.3602    17.9760    14.5239 
   H 172   11.1824     9.8683    13.4098     8.9696     9.0507     4.2078 
   H 173   10.6561     9.6357    14.1618     9.6799     8.3602     3.2886 
   H 174   13.1492    12.8769    18.0327    13.5833    10.4423     5.3083 
   H 175   14.6059    14.8580    20.8320    16.3646    11.7682     7.2058 
   H 176   17.9293    15.9800    14.1718    10.9615    16.0803    11.3299 
   H 177   17.9784    16.4814    16.4609    12.8366    15.7910    10.6509 
   H 178   21.6020    19.7093    17.0924    14.3541    19.6531    14.7139 
   H 179   21.7082    20.1883    19.1078    15.9217    19.4900    14.2973 
   H 180   14.2498    12.7893    14.3064    10.1940    12.1123     7.0944 
   H 181   14.2875    12.2526    11.7213     7.8822    12.6002     8.2517 
   H 182    9.6713     9.9267    17.3115    12.8235     6.8697     2.4215 
   H 183   11.4511    12.2739    20.1406    15.6492     8.5909     5.1743 

              H 145      H 146      H 147      H 148      H 149      H 150
              ------------------------------------------------------------------
   H 145    0.0000 
   H 146   11.4121     0.0000 
   H 147   11.7697     0.7971     0.0000 
   H 148    8.7529     8.7234     9.4929     0.0000 
   H 149    9.3322     9.4873    10.2653     0.8768     0.0000 
   H 150    8.7162     9.9300    10.6927     1.2399     0.8768     0.0000 
   H 151   18.4434     8.4569     8.7529    11.7697    12.0032    12.8422 
   H 152   18.5972     8.9803     9.3322    11.5979    11.7697    12.6242 
   H 153   17.7386     8.3166     8.7162    10.7332    10.9186    11.7696 
   H 154    8.8791    14.5324    15.2441     6.2450     5.8405     5.0501 
   H 155    9.7454    15.1908    15.9155     6.7399     6.2450     5.5129 
   H 156    9.6557    15.7713    16.4815     7.4547     7.0104     6.2451 
   H 157   14.2246     8.1590     8.8790     6.1222     6.1136     6.9889 
   H 158   14.6183     9.0197     9.7454     6.2549     6.1223     6.9965 
   H 159   13.8518     8.9023     9.6556     5.4030     5.2488     6.1222 
   H 160   12.8449     1.9203     1.2046    10.6389    11.3950    11.8485 
   H 161    1.2047    10.4054    10.7220     8.6411     9.3030     8.7755 
   H 162   10.7808     1.3415     2.1356     7.4039     8.1570     8.6187 
   H 163   11.5171     2.0285     2.7807     7.2478     7.9321     8.4850 
   H 164    2.1356    12.5802    13.0364     8.2568     8.6666     7.9233 
   H 165    2.7807    12.1380    12.6441     7.2555     7.6319     6.8736 
   H 166    3.4208     8.0141     8.3519     7.3264     8.1086     7.7725 
   H 167    3.0945     8.3518     8.7494     6.7692     7.5196     7.1307 
   H 168   15.1888     3.8856     3.4208    12.1512    12.8261    13.3884 
   H 169   14.8206     3.4208     3.0945    11.4400    12.0987    12.6790 
   H 170   15.1388     4.2079     3.5649    12.8050    13.5214    14.0320 
   H 171   14.0670     3.2887     2.5833    11.9855    12.7288    13.2013 
   H 172    3.5649     8.3282     8.5607     8.5157     9.3055     8.9769 
   H 173    2.5833     9.3667     9.6186     8.8016     9.5423     9.1231 
   H 174    4.5906    12.5202    12.5927    12.6924    13.3949    12.9040 
   H 175    6.6493    15.3084    15.3480    15.2236    15.8745    15.3137 
   H 176   10.6374     6.5620     6.0639    12.9903    13.8653    13.9457 
   H 177    9.8805     9.0543     8.6652    14.1682    15.0384    14.9603 
   H 178   13.9764     9.4556     8.7847    16.6660    17.5379    17.6496 
   H 179   13.5147    11.4528    10.8776    17.6800    18.5559    18.5384 
   H 180    6.3610     7.7880     7.7270    10.8051    11.6553    11.4808 
   H 181    7.6699     4.9566     4.9222     9.3593    10.2360    10.2625 
   H 182    2.1698    13.2750    13.5645    10.8585    11.3979    10.7382 
   H 183    5.0012    15.8424    16.0668    13.6283    14.1298    13.4338 

              H 151      H 152      H 153      H 154      H 155      H 156
              ------------------------------------------------------------------
   H 151    0.0000 
   H 152    0.8768     0.0000 
   H 153    1.2400     0.8768     0.0000 
   H 154   17.8204    17.5470    16.7096     0.0000 
   H 155   18.1322    17.8204    16.9965     0.8768     0.0000 
   H 156   18.9473    18.6492    17.8204     1.2400     0.8768     0.0000 
   H 157    6.2450     5.8406     5.0501    11.7696    12.0032    12.8422 
   H 158    6.7399     6.2450     5.5128    11.5979    11.7697    12.6243 
   H 159    7.4547     7.0105     6.2450    10.7331    10.9185    11.7696 
   H 160    8.6411     9.3029     8.7755    16.4394    17.1047    17.6774 
   H 161   17.6975    17.8968    17.0494     9.5757    10.4512    10.4436 
   H 162    8.2568     8.6666     7.9233    13.2911    13.9294    14.5311 
   H 163    7.2555     7.6319     6.8736    13.3262    13.9152    14.5632 
   H 164   18.9363    18.9930    18.1198     7.0688     7.9094     7.7205 
   H 165   18.1605    18.1831    17.3074     6.1365     6.9941     6.8771 
   H 166   15.3867    15.6218    14.7860     9.8507    10.7129    10.8999 
   H 167   15.4214    15.6128    14.7643     9.0559     9.9191    10.1029 
   H 168    7.3264     8.1086     7.7726    18.1949    18.8034    19.4342 
   H 169    6.7691     7.5195     7.1307    17.5243    18.1181    18.7623 
   H 170    8.5157     9.3055     8.9770    18.7257    19.3693    19.9654 
   H 171    8.8016     9.5423     9.1231    17.8171    18.4791    19.0554 
   H 172   16.0660    16.3526    15.5346    10.9159    11.7852    11.9274 
   H 173   16.9804    17.2377    16.4084    10.5462    11.4222    11.4900 
   H 174   20.5821    20.9084    20.1041    13.4638    14.3267    14.2030 
   H 175   23.4121    23.7399    22.9351    15.2004    16.0297    15.7747 
   H 176   14.7440    15.3656    14.7737    17.3302    18.1520    18.4691 
   H 177   17.4132    17.9960    17.3619    17.6478    18.5073    18.6964 
   H 178   16.8704    17.5968    17.1319    21.0460    21.8727    22.1748 
   H 179   19.3205    20.0059    19.4810    21.3748    22.2323    22.4278 
   H 180   16.1561    16.5931    15.8498    13.9238    14.7860    14.9655 
   H 181   13.3424    13.7991    13.0722    13.6234    14.4372    14.7769 
   H 182   20.5479    20.7229    19.8685    10.2223    11.0524    10.8134 
   H 183   23.3213    23.5164    22.6663    12.3060    13.0773    12.6969 

              H 157      H 158      H 159      H 160      H 161      H 162
              ------------------------------------------------------------------
   H 157    0.0000 
   H 158    0.8768     0.0000 
   H 159    1.2400     0.8769     0.0000 
   H 160    9.5755    10.4511    10.4435     0.0000 
   H 161   13.7906    14.2454    13.5165    11.7696     0.0000 
   H 162    7.0687     7.9094     7.7204     3.2381     9.8557     0.0000 
   H 163    6.1365     6.9941     6.8771     3.6740    10.6486     1.0739 
   H 164   14.1538    14.4271    13.6054    14.1734     3.2382    11.7697 
   H 165   13.2202    13.4630    12.6313    13.8077     3.6741    11.2442 
   H 166   11.8349    12.3699    11.7037     9.4243     2.3979     7.4627 
   H 167   11.5742    12.0648    11.3649     9.8598     2.2860     7.6872 
   H 168    9.8507    10.7129    10.8999     2.3980    14.1327     4.9497 
   H 169    9.0558     9.9190    10.1028     2.2860    13.7943     4.3563 
   H 170   10.9159    11.7852    11.9274     2.3715    14.0386     5.4400 
   H 171   10.5462    11.4222    11.4900     1.3799    12.9651     4.5826 
   H 172   12.8340    13.4038    12.7654     9.5507     2.3714     7.9568 
   H 173   13.4924    14.0181    13.3409    10.6190     1.3799     8.9434 
   H 174   17.4285    17.9709    17.3015    13.4068     4.1502    12.3672 
   H 175   20.1835    20.7001    20.0075    16.1150     6.5827    15.1901 
   H 176   14.4544    15.2743    14.9947     6.1351     9.4343     7.4173 
   H 177   16.5495    17.3256    16.9450     8.8839     8.7433     9.7024 
   H 178   17.5995    18.4510    18.2666     8.3989    12.7943    10.5508 
   H 179   19.4302    20.2521    19.9699    10.7081    12.4084    12.3805 
   H 180   14.0746    14.7671    14.2593     8.4286     5.1750     7.9281 
   H 181   11.6609    12.4109    11.9947     5.7091     6.4944     5.1547 
   H 182   16.3938    16.7821    16.0104    14.5828     2.8907    12.7461 
   H 183   19.2236    19.6047    18.8270    17.0228     5.6239    15.4084 

              H 163      H 164      H 165      H 166      H 167      H 168
              ------------------------------------------------------------------
   H 163    0.0000 
   H 164   12.3662     0.0000 
   H 165   11.7697     1.0739     0.0000 
   H 166    8.2753     4.9497     4.9034     0.0000 
   H 167    8.4278     4.3563     4.2031     0.7970     0.0000 
   H 168    4.9034    16.4426    16.0205    11.7697    12.1690     0.0000 
   H 169    4.2030    15.9972    15.5356    11.4121    11.7696     0.7971 
   H 170    5.6083    16.5205    16.1723    11.7240    12.1906     1.2046 
   H 171    4.9004    15.4618    15.1273    10.6534    11.1265     1.6621 
   H 172    8.8552     5.4400     5.6083     1.2046     1.9202    11.9374 
   H 173    9.8104     4.5826     4.9004     1.6621     2.0354    13.0031 
   H 174   13.3309     6.5044     7.3367     5.6011     5.9763    15.7907 
   H 175   16.1595     8.1396     9.1323     8.3516     8.6429    18.4816 
   H 176    8.4347    12.5802    12.6942     7.8178     8.5772     8.0751 
   H 177   10.7653    11.9807    12.3307     7.7991     8.5955    10.8977 
   H 178   11.4654    16.0109    16.2247    11.4182    12.1973     9.6270 
   H 179   13.3806    15.6353    16.0306    11.5291    12.3258    12.2094 
   H 180    8.9779     8.3946     8.6586     4.0732     4.8681    10.7847 
   H 181    6.2202     9.3825     9.3223     4.4406     5.1206     8.0989 
   H 182   13.5359     3.1683     4.1892     5.2853     5.1312    16.9616 
   H 183   16.2420     5.5809     6.6547     7.9672     7.9042    19.4186 

              H 169      H 170      H 171      H 172      H 173      H 174
              ------------------------------------------------------------------
   H 169    0.0000 
   H 170    1.9203     0.0000 
   H 171    2.0355     1.0739     0.0000 
   H 172   11.6539    11.7697    10.6963     0.0000 
   H 173   12.7097    12.8432    11.7697     1.0739     0.0000 
   H 174   15.6450    15.3891    14.3488     4.6231     3.9631     0.0000 
   H 175   18.3738    18.0153    16.9943     7.4334     6.6916     2.8315 
   H 176    8.2906     7.2490     6.4166     7.1402     8.0545     9.1277 
   H 177   11.0858    10.0800     9.2423     6.7968     7.4349     7.2569 
   H 178   10.1072     8.5160     8.0718    10.6181    11.4299    11.6278 
   H 179   12.6155    11.1542    10.5942    10.5258    11.1302    10.3629 
   H 180   10.7002    10.3272     9.2983     3.0754     3.8120     5.0787 
   H 181    7.9480     7.7737     6.7117     4.1329     5.1928     7.6995 
   H 182   16.6483    16.8127    15.7393     5.0431     3.9697     3.7321 
   H 183   19.1613    19.1718    18.1054     7.5152     6.4802     4.3715 

              H 175      H 176      H 177      H 178      H 179      H 180
              ------------------------------------------------------------------
   H 175    0.0000 
   H 176   11.4018     0.0000 
   H 177    9.1277     2.8315     0.0000 
   H 178   13.3812     3.7321     4.3715     0.0000 
   H 179   11.6278     4.9782     3.7321     2.8315     0.0000 
   H 180    7.6995     4.3714     3.7320     7.6196     7.4641     0.0000 
   H 181   10.4310     3.7320     4.9781     7.4641     8.3308     2.8315 
   H 182    4.9782    11.6278    10.3629    14.6613    13.7831     7.2570 
   H 183    3.7321    13.3812    11.6278    15.9990    14.6613     9.1278 

              H 181      H 182      H 183
              ---------------------------------
   H 181    0.0000 
   H 182    9.1278     0.0000 
   H 183   11.4019     2.8315     0.0000 



ATOMIC CHARGES
   S   1    0.2050592327
   S   2    0.2050592327
   S   3    0.2050592327
   S   4    0.2050592327
   S   5    0.2050592327
   O   6   -0.3412960717
   O   7   -0.3412960717
   O   8   -0.3328246592
   O   9   -0.3328246592
   O  10   -0.3865417522
   O  11   -0.3865417522
   O  12   -0.3458554979
   O  13   -0.3458554979
   O  14   -0.3851209444
   O  15   -0.3851209444
   O  16   -0.3849299577
   O  17   -0.3849299577
   O  18   -0.4652752563
   O  19   -0.4652752563
   O  20   -0.2312186882
   O  21   -0.2312186882
   O  22   -0.2312186882
   O  23   -0.2312186882
   O  24   -0.2312186882
   O  25   -0.2312186882
   O  26   -0.2312186882
   O  27   -0.2312186882
   O  28   -0.2312186882
   O  29   -0.2312186882
   O  30   -0.1182520766
   O  31   -0.1182520766
   O  32   -0.1182520766
   O  33   -0.1182520766
   O  34   -0.1182520766
   O  35   -0.1182520766
   O  36   -0.1182520766
   O  37   -0.1182520766
   O  38   -0.1182520766
   O  39   -0.1182520766
   N  40   -0.3109694131
   N  41   -0.3109694131
   N  42   -0.3250119127
   N  43   -0.3250119127
   N  44   -0.3114571173
   N  45   -0.3114571173
   N  46   -0.3220539225
   N  47   -0.3220539225
   N  48   -0.3237011746
   N  49   -0.3237011746
   C  50    0.1053360590
   C  51    0.1053360590
   C  52    0.0379710946
   C  53    0.0379710946
   C  54    0.1104584783
   C  55    0.1104584783
   C  56    0.1060992770
   C  57    0.1060992770
   C  58    0.0355376413
   C  59    0.0355376413
   C  60   -0.0172882521
   C  61   -0.0172882521
   C  62    0.1870341588
   C  63    0.1870341588
   C  64    0.1238571452
   C  65    0.1238571452
   C  66    0.0692241694
   C  67    0.0692241694
   C  68    0.1043011000
   C  69    0.1043011000
   C  70    0.0807826772
   C  71    0.0807826772
   C  72    0.2172077190
   C  73    0.2172077190
   C  74   -0.0066040534
   C  75   -0.0066040534
   C  76    0.0716984655
   C  77    0.0716984655
   C  78   -0.0323308854
   C  79   -0.0323308854
   C  80   -0.0102327691
   C  81   -0.0102327691
   C  82   -0.0525878924
   C  83   -0.0525878924
   C  84   -0.0153693165
   C  85   -0.0153693165
   C  86    0.1107870051
   C  87    0.1107870051
   C  88   -0.0434158608
   C  89   -0.0434158608
   C  90    0.0513010249
   C  91    0.0513010249
   H  92    0.0639289295
   H  93    0.0639289295
   H  94    0.0487094563
   H  95    0.0487094563
   H  96    0.0646206979
   H  97    0.0646206979
   H  98    0.0639570356
   H  99    0.0639570356
   H 100    0.0485010737
   H 101    0.0485010737
   H 102    0.0296864531
   H 103    0.0296864531
   H 104    0.0296864531
   H 105    0.0296864531
   H 106    0.0937044733
   H 107    0.0937044733
   H 108    0.0660638154
   H 109    0.0660638154
   H 110    0.0516577899
   H 111    0.0516577899
   H 112    0.1222758403
   H 113    0.1222758403
   H 114    0.1185494064
   H 115    0.1185494064
   H 116    0.1185494064
   H 117    0.1185494064
   H 118    0.0589824797
   H 119    0.0589824797
   H 120    0.0589824797
   H 121    0.0589824797
   H 122    0.1072058627
   H 123    0.1072058627
   H 124    0.2100026679
   H 125    0.2100026679
   H 126    0.0421375986
   H 127    0.0421375986
   H 128    0.0421375986
   H 129    0.0421375986
   H 130    0.0522979008
   H 131    0.0522979008
   H 132    0.0258481775
   H 133    0.0258481775
   H 134    0.0258481775
   H 135    0.0258481775
   H 136    0.0258481775
   H 137    0.0258481775
   H 138    0.1220650105
   H 139    0.1220650105
   H 140    0.2100661088
   H 141    0.2100661088
   H 142    0.2103164397
   H 143    0.2103164397
   H 144    0.0325451629
   H 145    0.0325451629
   H 146    0.0325451629
   H 147    0.0325451629
   H 148    0.0241927579
   H 149    0.0241927579
   H 150    0.0241927579
   H 151    0.0241927579
   H 152    0.0241927579
   H 153    0.0241927579
   H 154    0.0388182071
   H 155    0.0388182071
   H 156    0.0388182071
   H 157    0.0388182071
   H 158    0.0388182071
   H 159    0.0388182071
   H 160    0.0605786256
   H 161    0.0605786256
   H 162    0.1186612479
   H 163    0.1186612479
   H 164    0.1186612479
   H 165    0.1186612479
   H 166    0.0502021609
   H 167    0.0502021609
   H 168    0.0502021609
   H 169    0.0502021609
   H 170    0.1186062598
   H 171    0.1186062598
   H 172    0.1186062598
   H 173    0.1186062598
   H 174    0.2469411485
   H 175    0.2469411485
   H 176    0.2469411485
   H 177    0.2469411485
   H 178    0.2469411485
   H 179    0.2469411485
   H 180    0.2469411485
   H 181    0.2469411485
   H 182    0.2469411485
   H 183    0.2469411485


BOND ANGLES
  20    1   29   O3  So2   O3    179.974
  20    1   30   O3  So2   O2     90.000
  20    1   31   O3  So2   O2     90.000
  29    1   30   O3  So2   O2     89.997
  29    1   31   O3  So2   O2     90.003
  30    1   31   O2  So2   O2    179.974
  27    2   28   O3  So2   O3    179.974
  27    2   32   O3  So2   O2     90.000
  27    2   33   O3  So2   O2     90.003
  28    2   32   O3  So2   O2     89.997
  28    2   33   O3  So2   O2     90.000
  32    2   33   O2  So2   O2    179.974
  25    3   26   O3  So2   O3    179.974
  25    3   34   O3  So2   O2     89.997
  25    3   35   O3  So2   O2     90.000
  26    3   34   O3  So2   O2     90.000
  26    3   35   O3  So2   O2     90.003
  34    3   35   O2  So2   O2    179.974
  23    4   24   O3  So2   O3    179.974
  23    4   36   O3  So2   O2     89.997
  23    4   37   O3  So2   O2     90.000
  24    4   36   O3  So2   O2     90.000
  24    4   37   O3  So2   O2     90.003
  36    4   37   O2  So2   O2    179.974
  21    5   22   O3  So2   O3    179.974
  21    5   38   O3  So2   O2     90.000
  21    5   39   O3  So2   O2     90.000
  22    5   38   O3  So2   O2     89.997
  22    5   39   O3  So2   O2     90.003
  38    5   39   O2  So2   O2    179.974
  50    6   63   C3   O3   C3    119.998
  51    7   62   C3   O3   C3    120.001
  57    8   73   C3   O3   C3    149.991
  56    9   72   C3   O3   C3    149.996
  55   10  125   C3   O3   HO    120.000
  54   11  124   C3   O3   HO    119.998
  62   12   71   C3   O3   C3    120.001
  63   13   70   C3   O3   C3    119.999
  64   14  140   C3   O3   HO    119.998
  65   15  141   C3   O3   HO    120.000
  69   16  143   C3   O3   HO    120.002
  68   17  142   C3   O3   HO    120.002
  73   18   86   C3   O2   C2    120.004
  72   19   87   C3   O2   C2    120.004
   1   20  178  So2   O3   HO    119.998
   5   21  182  So2   O3   HO    119.998
   5   22  183  So2   O3   HO    120.000
   4   23  181  So2   O3   HO    119.998
   4   24  180  So2   O3   HO    120.000
   3   25  174  So2   O3   HO    119.998
   3   26  175  So2   O3   HO    120.000
   2   27  176  So2   O3   HO    119.998
   2   28  177  So2   O3   HO    120.000
   1   29  179  So2   O3   HO    120.000
  53   40   74   C3   N3   C3    119.999
  53   40  112   C3   N3   HC    120.001
  74   40  112   C3   N3   HC    120.001
  52   41   75   C3   N3   C3    119.999
  52   41  113   C3   N3   HC    120.001
  75   41  113   C3   N3   HC    120.001
  58   42  114   C3   N3   HC    120.006
  58   42  115   C3   N3   HC    119.985
 114   42  115   HC   N3   HC    120.010
  59   43  116   C3   N3   HC    120.013
  59   43  117   C3   N3   HC    119.999
 116   43  117   HC   N3   HC    119.988
  67   44   85   C3   N3   C3    120.001
  67   44  138   C3   N3   HC    120.002
  85   44  138   C3   N3   HC    119.998
  66   45   84   C3   N3   C3    119.998
  66   45  139   C3   N3   HC    120.002
  84   45  139   C3   N3   HC    120.000
  76   46  162   C3   N3   HC    119.998
  76   46  163   C3   N3   HC    120.000
 162   46  163   HC   N3   HC    120.002
  77   47  164   C3   N3   HC    119.998
  77   47  165   C3   N3   HC    120.000
 164   47  165   HC   N3   HC    120.002
  90   48  170   C3   N3   HC    119.998
  90   48  171   C3   N3   HC    120.001
 170   48  171   HC   N3   HC    120.002
  91   49  172   C3   N3   HC    119.998
  91   49  173   C3   N3   HC    120.001
 172   49  173   HC   N3   HC    120.002
   6   50   53   O3   C3   C3    120.001
   6   50   54   O3   C3   C3    119.998
   6   50   92   O3   C3   HC     59.998
  53   50   54   C3   C3   C3    120.001
  53   50   92   C3   C3   HC     60.002
  54   50   92   C3   C3   HC    179.974
   7   51   52   O3   C3   C3    120.001
   7   51   55   O3   C3   C3    120.001
   7   51   93   O3   C3   HC     60.003
  52   51   55   C3   C3   C3    119.999
  52   51   93   C3   C3   HC    179.974
  55   51   93   C3   C3   HC     59.998
  41   52   51   N3   C3   C3    119.999
  41   52   60   N3   C3   C3    120.001
  41   52   95   N3   C3   HC     59.999
  51   52   60   C3   C3   C3    120.001
  51   52   95   C3   C3   HC     59.999
  60   52   95   C3   C3   HC    179.974
  40   53   50   N3   C3   C3    119.999
  40   53   61   N3   C3   C3    120.001
  40   53   94   N3   C3   HC     60.002
  50   53   61   C3   C3   C3    120.001
  50   53   94   C3   C3   HC    179.974
  61   53   94   C3   C3   HC     59.998
  11   54   50   O3   C3   C3    120.001
  11   54   56   O3   C3   C3    120.001
  11   54   97   O3   C3   HC     60.002
  50   54   56   C3   C3   C3    119.998
  50   54   97   C3   C3   HC    179.974
  56   54   97   C3   C3   HC     59.998
  10   55   51   O3   C3   C3    120.001
  10   55   57   O3   C3   C3    119.998
  10   55   96   O3   C3   HC     60.002
  51   55   57   C3   C3   C3    120.001
  51   55   96   C3   C3   HC     59.999
  57   55   96   C3   C3   HC    179.974
   9   56   54   O3   C3   C3    120.001
   9   56   59   O3   C3   C3    120.001
   9   56   98   O3   C3   HC     60.002
  54   56   59   C3   C3   C3    119.998
  54   56   98   C3   C3   HC     59.998
  59   56   98   C3   C3   HC    179.974
   8   57   55   O3   C3   C3    119.998
   8   57   58   O3   C3   C3    120.001
   8   57   99   O3   C3   HC     60.002
  55   57   58   C3   C3   C3    120.001
  55   57   99   C3   C3   HC    179.974
  58   57   99   C3   C3   HC     59.999
  42   58   57   N3   C3   C3    150.006
  42   58   60   N3   C3   C3     89.995
  42   58  100   N3   C3   HC     75.006
  57   58   60   C3   C3   C3    119.999
  57   58  100   C3   C3   HC     75.001
  60   58  100   C3   C3   HC    165.001
  43   59   56   N3   C3   C3    150.001
  43   59   61   N3   C3   C3     89.997
  43   59  101   N3   C3   HC     75.004
  56   59   61   C3   C3   C3    120.001
  56   59  101   C3   C3   HC     74.998
  61   59  101   C3   C3   HC    165.001
  52   60   58   C3   C3   C3    120.001
  52   60  102   C3   C3   HC    160.004
  52   60  103   C3   C3   HC     79.997
  58   60  102   C3   C3   HC     79.995
  58   60  103   C3   C3   HC    160.002
 102   60  103   HC   C3   HC     80.007
  53   61   59   C3   C3   C3    120.001
  53   61  104   C3   C3   HC    160.004
  53   61  105   C3   C3   HC     79.997
  59   61  104   C3   C3   HC     79.995
  59   61  105   C3   C3   HC    160.002
 104   61  105   HC   C3   HC     80.007
   7   62   12   O3   C3   O3    120.001
   7   62   64   O3   C3   C3    120.001
   7   62  107   O3   C3   HC     60.002
  12   62   64   O3   C3   C3    119.998
  12   62  107   O3   C3   HC    179.974
  64   62  107   C3   C3   HC     59.998
   6   63   13   O3   C3   O3    120.001
   6   63   65   O3   C3   C3    119.998
   6   63  106   O3   C3   HC     59.995
  13   63   65   O3   C3   C3    120.001
  13   63  106   O3   C3   HC    179.974
  65   63  106   C3   C3   HC     60.003
  14   64   62   O3   C3   C3    120.001
  14   64   66   O3   C3   C3    120.001
  14   64  109   O3   C3   HC     60.002
  62   64   66   C3   C3   C3    119.998
  62   64  109   C3   C3   HC     59.998
  66   64  109   C3   C3   HC    179.974
  15   65   63   O3   C3   C3    119.998
  15   65   67   O3   C3   C3    120.001
  15   65  108   O3   C3   HC     59.995
  63   65   67   C3   C3   C3    120.001
  63   65  108   C3   C3   HC     60.003
  67   65  108   C3   C3   HC    179.974
  45   66   64   N3   C3   C3    119.998
  45   66   69   N3   C3   C3    120.001
  45   66  111   N3   C3   HC     59.998
  64   66   69   C3   C3   C3    120.001
  64   66  111   C3   C3   HC    179.974
  69   66  111   C3   C3   HC     60.002
  44   67   65   N3   C3   C3    120.001
  44   67   68   N3   C3   C3    120.001
  44   67  110   N3   C3   HC     59.998
  65   67   68   C3   C3   C3    119.999
  65   67  110   C3   C3   HC     60.002
  68   67  110   C3   C3   HC    179.974
  17   68   67   O3   C3   C3    149.999
  17   68   70   O3   C3   C3     90.000
  17   68   79   O3   C3   C3     60.002
  67   68   70   C3   C3   C3    120.001
  67   68   79   C3   C3   C3     89.997
  70   68   79   C3   C3   C3    150.002
  16   69   66   O3   C3   C3    149.999
  16   69   71   O3   C3   C3     90.000
  16   69   78   O3   C3   C3     59.999
  66   69   71   C3   C3   C3    120.001
  66   69   78   C3   C3   C3     90.000
  71   69   78   C3   C3   C3    149.999
  13   70   68   O3   C3   C3    120.001
  13   70  120   O3   C3   HC    160.002
  13   70  121   O3   C3   HC     80.004
  68   70  120   C3   C3   HC     79.997
  68   70  121   C3   C3   HC    159.996
 120   70  121   HC   C3   HC     79.999
  12   71   69   O3   C3   C3    120.001
  12   71  118   O3   C3   HC    160.002
  12   71  119   O3   C3   HC     80.004
  69   71  118   C3   C3   HC     79.997
  69   71  119   C3   C3   HC    159.996
 118   71  119   HC   C3   HC     79.999
   9   72   19   O3   C3   O2    120.008
   9   72   76   O3   C3   C3    119.996
   9   72  123   O3   C3   HC     59.997
  19   72   76   O2   C3   C3    119.996
  19   72  123   O2   C3   HC    179.974
  76   72  123   C3   C3   HC     59.998
   8   73   18   O3   C3   O2    120.008
   8   73   77   O3   C3   C3    119.987
   8   73  122   O3   C3   HC     59.990
  18   73   77   O2   C3   C3    120.004
  18   73  122   O2   C3   HC    179.974
  77   73  122   C3   C3   HC     59.997
  40   74   83   N3   C3   C3    120.001
  40   74  126   N3   C3   HC     80.000
  40   74  127   N3   C3   HC    160.009
  83   74  126   C3   C3   HC    159.999
  83   74  127   C3   C3   HC     79.990
 126   74  127   HC   C3   HC     80.009
  41   75   82   N3   C3   C3    120.001
  41   75  128   N3   C3   HC     80.000
  41   75  129   N3   C3   HC    160.009
  82   75  128   C3   C3   HC    159.999
  82   75  129   C3   C3   HC     79.990
 128   75  129   HC   C3   HC     80.009
  46   76   72   N3   C3   C3    119.998
  46   76   80   N3   C3   C3    120.004
  46   76  130   N3   C3   HC     60.002
  72   76   80   C3   C3   C3    119.998
  72   76  130   C3   C3   HC    179.974
  80   76  130   C3   C3   HC     60.002
  47   77   73   N3   C3   C3    120.004
  47   77   81   N3   C3   C3    120.009
  47   77  131   N3   C3   HC     60.002
  73   77   81   C3   C3   C3    119.987
  73   77  131   C3   C3   HC    179.974
  81   77  131   C3   C3   HC     60.007
  69   78  135   C3   C3   HC     90.001
  69   78  136   C3   C3   HC    179.974
  69   78  137   C3   C3   HC     89.999
 135   78  136   HC   C3   HC     89.995
 135   78  137   HC   C3   HC    179.974
 136   78  137   HC   C3   HC     90.005
  68   79  132   C3   C3   HC     90.004
  68   79  133   C3   C3   HC    179.974
  68   79  134   C3   C3   HC     90.001
 132   79  133   HC   C3   HC     90.000
 132   79  134   HC   C3   HC    179.974
 133   79  134   HC   C3   HC     89.995
  76   80   89   C3   C3   C2    119.996
  76   80  146   C3   C3   HC     79.990
  76   80  147   C3   C3   HC    159.999
  89   80  146   C2   C3   HC    160.014
  89   80  147   C2   C3   HC     80.005
 146   80  147   HC   C3   HC     80.009
  77   81   88   C3   C3   C2    120.006
  77   81  144   C3   C3   HC     79.998
  77   81  145   C3   C3   HC    159.988
  88   81  144   C2   C3   HC    159.996
  88   81  145   C2   C3   HC     80.006
 144   81  145   HC   C3   HC     79.990
  75   82  148   C3   C3   HC     90.004
  75   82  149   C3   C3   HC    179.974
  75   82  150   C3   C3   HC     89.996
 148   82  149   HC   C3   HC     90.000
 148   82  150   HC   C3   HC    179.974
 149   82  150   HC   C3   HC     90.000
  74   83  151   C3   C3   HC     90.004
  74   83  152   C3   C3   HC    179.974
  74   83  153   C3   C3   HC     90.001
 151   83  152   HC   C3   HC     90.000
 151   83  153   HC   C3   HC    179.974
 152   83  153   HC   C3   HC     89.995
  45   84  154   N3   C3   HC     90.004
  45   84  155   N3   C3   HC    179.974
  45   84  156   N3   C3   HC     90.001
 154   84  155   HC   C3   HC     90.000
 154   84  156   HC   C3   HC    179.974
 155   84  156   HC   C3   HC     89.995
  44   85  157   N3   C3   HC     90.001
  44   85  158   N3   C3   HC    179.974
  44   85  159   N3   C3   HC     90.004
 157   85  158   HC   C3   HC     89.995
 157   85  159   HC   C3   HC    179.974
 158   85  159   HC   C3   HC     90.000
  18   86   88   O2   C2   C2    119.998
  18   86   91   O2   C2   C3    120.001
  88   86   91   C2   C2   C3    120.001
  19   87   89   O2   C2   C2    120.006
  19   87   90   O2   C2   C3    120.001
  89   87   90   C2   C2   C3    119.992
  81   88   86   C3   C2   C2    120.001
  81   88  161   C3   C2   HC    120.002
  86   88  161   C2   C2   HC    119.997
  80   89   87   C3   C2   C2    120.000
  80   89  160   C3   C2   HC    119.993
  87   89  160   C2   C2   HC    120.007
  48   90   87   N3   C3   C2    120.001
  48   90  168   N3   C3   HC     80.006
  48   90  169   N3   C3   HC    160.003
  87   90  168   C2   C3   HC    159.993
  87   90  169   C2   C3   HC     79.996
 168   90  169   HC   C3   HC     79.997
  49   91   86   N3   C3   C2    119.999
  49   91  166   N3   C3   HC     80.006
  49   91  167   N3   C3   HC    159.996
  86   91  166   C2   C3   HC    159.996
  86   91  167   C2   C3   HC     80.006
 166   91  167   HC   C3   HC     79.990


TORSION ANGLES
  29    1   20  178    179.974
  30    1   20  178    179.974
  31    1   20  178      0.026
  20    1   29  179      0.026
  30    1   29  179      0.026
  31    1   29  179    179.974
  28    2   27  176    179.974
  32    2   27  176    179.974
  33    2   27  176      0.026
  27    2   28  177      0.026
  32    2   28  177      0.026
  33    2   28  177    179.974
  26    3   25  174    179.974
  34    3   25  174    179.974
  35    3   25  174      0.026
  25    3   26  175      0.026
  34    3   26  175      0.026
  35    3   26  175    179.974
  24    4   23  181    179.974
  36    4   23  181    179.974
  37    4   23  181      0.026
  23    4   24  180      0.026
  36    4   24  180      0.026
  37    4   24  180    179.974
  22    5   21  182    179.974
  38    5   21  182    179.974
  39    5   21  182      0.026
  21    5   22  183      0.026
  38    5   22  183      0.026
  39    5   22  183    179.974
  53   50    6   63    179.974
  54   50    6   63      0.026
  92   50    6   63    179.974
  13   63    6   50      0.026
  65   63    6   50    179.974
 106   63    6   50    179.974
  52   51    7   62    179.974
  55   51    7   62      0.026
  93   51    7   62      0.026
  12   62    7   51      0.026
  64   62    7   51    179.974
 107   62    7   51    179.974
  55   57    8   73    179.974
  58   57    8   73      0.026
  99   57    8   73      0.026
  18   73    8   57      0.026
  77   73    8   57    179.974
 122   73    8   57    179.974
  54   56    9   72    179.974
  59   56    9   72      0.026
  98   56    9   72    179.974
  19   72    9   56      0.026
  76   72    9   56    179.974
 123   72    9   56    179.974
  51   55   10  125    179.974
  57   55   10  125      0.026
  96   55   10  125    179.974
  50   54   11  124    179.974
  56   54   11  124      0.026
  97   54   11  124      0.026
  71   12   62    7    179.974
  71   12   62   64      0.026
  71   12   62  107      0.026
  62   12   71   69      0.026
  62   12   71  118    179.974
  62   12   71  119    179.974
  70   13   63    6    179.974
  70   13   63   65      0.026
  70   13   63  106    179.974
  63   13   70   68      0.026
  63   13   70  120    179.974
  63   13   70  121    179.974
  62   64   14  140      0.026
  66   64   14  140    179.974
 109   64   14  140      0.026
  63   65   15  141      0.026
  67   65   15  141    179.974
 108   65   15  141      0.026
  66   69   16  143    179.974
  71   69   16  143      0.026
  78   69   16  143    179.974
  67   68   17  142    179.974
  70   68   17  142      0.026
  79   68   17  142    179.974
  86   18   73    8    179.974
  86   18   73   77      0.026
  86   18   73  122    179.974
  73   18   86   88      0.026
  73   18   86   91    179.974
  87   19   72    9    179.974
  87   19   72   76      0.026
  87   19   72  123      0.026
  72   19   87   89      0.026
  72   19   87   90    179.974
  50   53   40   74    179.974
  50   53   40  112      0.026
  61   53   40   74      0.026
  61   53   40  112    179.974
  94   53   40   74      0.026
  94   53   40  112    179.974
  53   40   74   83    179.974
  53   40   74  126      0.026
  53   40   74  127      0.026
 112   40   74   83      0.026
 112   40   74  126    179.974
 112   40   74  127    179.974
  51   52   41   75    179.974
  51   52   41  113      0.026
  60   52   41   75      0.026
  60   52   41  113    179.974
  95   52   41   75    179.974
  95   52   41  113      0.026
  52   41   75   82    179.974
  52   41   75  128      0.026
  52   41   75  129      0.026
 113   41   75   82      0.026
 113   41   75  128    179.974
 113   41   75  129    179.974
  57   58   42  114    179.974
  57   58   42  115      0.026
  60   58   42  114      0.026
  60   58   42  115    179.974
 100   58   42  114    179.974
 100   58   42  115      0.026
  56   59   43  116    179.974
  56   59   43  117      0.026
  61   59   43  116      0.026
  61   59   43  117    179.974
 101   59   43  116    179.974
 101   59   43  117      0.026
  65   67   44   85      0.026
  65   67   44  138    179.974
  68   67   44   85    179.974
  68   67   44  138      0.026
 110   67   44   85      0.026
 110   67   44  138    179.974
  67   44   85  157      0.026
  67   44   85  158      0.026
  67   44   85  159    179.974
 138   44   85  157    179.974
 138   44   85  158    179.974
 138   44   85  159      0.026
  64   66   45   84      0.026
  64   66   45  139    179.974
  69   66   45   84    179.974
  69   66   45  139      0.026
 111   66   45   84    179.974
 111   66   45  139      0.026
  66   45   84  154      0.026
  66   45   84  155    179.974
  66   45   84  156    179.974
 139   45   84  154    179.974
 139   45   84  155      0.026
 139   45   84  156      0.026
  72   76   46  162    179.974
  72   76   46  163      0.026
  80   76   46  162      0.026
  80   76   46  163    179.974
 130   76   46  162      0.026
 130   76   46  163    179.974
  73   77   47  164    179.974
  73   77   47  165      0.026
  81   77   47  164      0.026
  81   77   47  165    179.974
 131   77   47  164      0.026
 131   77   47  165    179.974
 170   48   90   87    179.974
 170   48   90  168      0.026
 170   48   90  169      0.026
 171   48   90   87      0.026
 171   48   90  168    179.974
 171   48   90  169    179.974
 172   49   91   86    179.974
 172   49   91  166      0.026
 172   49   91  167      0.026
 173   49   91   86      0.026
 173   49   91  166    179.974
 173   49   91  167    179.974
   6   50   53   40      0.026
   6   50   53   61    179.974
   6   50   53   94    179.974
  54   50   53   40    179.974
  54   50   53   61      0.026
  54   50   53   94      0.026
  92   50   53   40      0.026
  92   50   53   61    179.974
  92   50   53   94    179.974
   6   50   54   11      0.026
   6   50   54   56    179.974
   6   50   54   97    179.974
  53   50   54   11    179.974
  53   50   54   56      0.026
  53   50   54   97      0.026
  92   50   54   11      0.026
  92   50   54   56    179.974
  92   50   54   97    179.974
   7   51   52   41      0.026
   7   51   52   60    179.974
   7   51   52   95      0.026
  55   51   52   41    179.974
  55   51   52   60      0.026
  55   51   52   95    179.974
  93   51   52   41    179.974
  93   51   52   60      0.026
  93   51   52   95    179.974
   7   51   55   10      0.026
   7   51   55   57    179.974
   7   51   55   96      0.026
  52   51   55   10    179.974
  52   51   55   57      0.026
  52   51   55   96    179.974
  93   51   55   10      0.026
  93   51   55   57    179.974
  93   51   55   96      0.026
  41   52   60   58    179.974
  41   52   60  102      0.026
  41   52   60  103      0.026
  51   52   60   58      0.026
  51   52   60  102    179.974
  51   52   60  103    179.974
  95   52   60   58    180.000
  95   52   60  102    180.000
  95   52   60  103    180.000
  40   53   61   59    179.974
  40   53   61  104      0.026
  40   53   61  105      0.026
  50   53   61   59      0.026
  50   53   61  104    179.974
  50   53   61  105    179.974
  94   53   61   59    179.974
  94   53   61  104      0.026
  94   53   61  105      0.026
  11   54   56    9      0.026
  11   54   56   59    179.974
  11   54   56   98      0.026
  50   54   56    9    179.974
  50   54   56   59      0.026
  50   54   56   98    179.974
  97   54   56    9      0.026
  97   54   56   59    179.974
  97   54   56   98      0.026
  10   55   57    8      0.026
  10   55   57   58    179.974
  10   55   57   99    180.000
  51   55   57    8    179.974
  51   55   57   58      0.026
  51   55   57   99    180.000
  96   55   57    8    180.000
  96   55   57   58    180.000
  96   55   57   99    180.000
   9   56   59   43      0.026
   9   56   59   61    179.974
   9   56   59  101      0.026
  54   56   59   43    179.974
  54   56   59   61      0.026
  54   56   59  101    179.974
  98   56   59   43    179.974
  98   56   59   61      0.026
  98   56   59  101    179.974
   8   57   58   42      0.026
   8   57   58   60    179.974
   8   57   58  100      0.026
  55   57   58   42    179.974
  55   57   58   60      0.026
  55   57   58  100    179.974
  99   57   58   42      0.026
  99   57   58   60    179.974
  99   57   58  100      0.026
  42   58   60   52    179.974
  42   58   60  102      0.026
  42   58   60  103      0.026
  57   58   60   52      0.026
  57   58   60  102    179.974
  57   58   60  103    179.974
 100   58   60   52    179.974
 100   58   60  102      0.026
 100   58   60  103      0.026
  43   59   61   53    179.974
  43   59   61  104      0.026
  43   59   61  105      0.026
  56   59   61   53      0.026
  56   59   61  104    179.974
  56   59   61  105    179.974
 101   59   61   53    179.974
 101   59   61  104      0.026
 101   59   61  105      0.026
   7   62   64   14      0.026
   7   62   64   66    179.974
   7   62   64  109      0.026
  12   62   64   14    179.974
  12   62   64   66      0.026
  12   62   64  109    179.974
 107   62   64   14      0.026
 107   62   64   66    179.974
 107   62   64  109      0.026
   6   63   65   15      0.026
   6   63   65   67    179.974
   6   63   65  108      0.026
  13   63   65   15    179.974
  13   63   65   67      0.026
  13   63   65  108    179.974
 106   63   65   15      0.026
 106   63   65   67    179.974
 106   63   65  108      0.026
  14   64   66   45      0.026
  14   64   66   69    179.974
  14   64   66  111      0.026
  62   64   66   45    179.974
  62   64   66   69      0.026
  62   64   66  111    179.974
 109   64   66   45    179.974
 109   64   66   69      0.026
 109   64   66  111    179.974
  15   65   67   44      0.026
  15   65   67   68    179.974
  15   65   67  110      0.026
  63   65   67   44    179.974
  63   65   67   68      0.026
  63   65   67  110    179.974
 108   65   67   44      0.026
 108   65   67   68    179.974
 108   65   67  110      0.026
  45   66   69   16      0.026
  45   66   69   71    179.974
  45   66   69   78      0.026
  64   66   69   16    179.974
  64   66   69   71      0.026
  64   66   69   78    179.974
 111   66   69   16      0.026
 111   66   69   71    179.974
 111   66   69   78      0.026
  44   67   68   17      0.026
  44   67   68   70    179.974
  44   67   68   79      0.026
  65   67   68   17    179.974
  65   67   68   70      0.026
  65   67   68   79    179.974
 110   67   68   17      0.026
 110   67   68   70    179.974
 110   67   68   79      0.026
  17   68   70   13    179.974
  17   68   70  120      0.026
  17   68   70  121      0.026
  67   68   70   13      0.026
  67   68   70  120    179.974
  67   68   70  121    179.974
  79   68   70   13    179.974
  79   68   70  120      0.026
  79   68   70  121      0.026
  17   68   79  132    179.974
  17   68   79  133      0.026
  17   68   79  134      0.026
  67   68   79  132      0.026
  67   68   79  133    179.974
  67   68   79  134    179.974
  70   68   79  132    179.974
  70   68   79  133      0.026
  70   68   79  134      0.026
  16   69   71   12    179.974
  16   69   71  118      0.026
  16   69   71  119      0.026
  66   69   71   12      0.026
  66   69   71  118    179.974
  66   69   71  119    179.974
  78   69   71   12    179.974
  78   69   71  118      0.026
  78   69   71  119      0.026
  16   69   78  135    179.974
  16   69   78  136    179.974
  16   69   78  137      0.026
  66   69   78  135      0.026
  66   69   78  136      0.026
  66   69   78  137    179.974
  71   69   78  135    179.974
  71   69   78  136    179.974
  71   69   78  137      0.026
   9   72   76   46      0.026
   9   72   76   80    179.974
   9   72   76  130    180.000
  19   72   76   46    179.974
  19   72   76   80      0.026
  19   72   76  130    180.000
 123   72   76   46      0.026
 123   72   76   80    179.974
 123   72   76  130    180.000
   8   73   77   47      0.026
   8   73   77   81    179.974
   8   73   77  131    179.974
  18   73   77   47    179.974
  18   73   77   81      0.026
  18   73   77  131      0.026
 122   73   77   47      0.026
 122   73   77   81    179.974
 122   73   77  131    179.974
  40   74   83  151    179.974
  40   74   83  152      0.026
  40   74   83  153      0.026
 126   74   83  151      0.026
 126   74   83  152    179.974
 126   74   83  153    179.974
 127   74   83  151      0.026
 127   74   83  152    179.974
 127   74   83  153    179.974
  41   75   82  148    179.974
  41   75   82  149      0.026
  41   75   82  150      0.026
 128   75   82  148      0.026
 128   75   82  149    179.974
 128   75   82  150    179.974
 129   75   82  148      0.026
 129   75   82  149    179.974
 129   75   82  150    179.974
  46   76   80   89    179.974
  46   76   80  146      0.026
  46   76   80  147      0.026
  72   76   80   89      0.026
  72   76   80  146    179.974
  72   76   80  147    179.974
 130   76   80   89    179.974
 130   76   80  146      0.026
 130   76   80  147      0.026
  47   77   81   88    179.974
  47   77   81  144      0.026
  47   77   81  145      0.026
  73   77   81   88      0.026
  73   77   81  144    179.974
  73   77   81  145    179.974
 131   77   81   88    179.974
 131   77   81  144      0.026
 131   77   81  145      0.026
  76   80   89   87      0.026
  76   80   89  160    179.974
 146   80   89   87    179.974
 146   80   89  160      0.026
 147   80   89   87    179.974
 147   80   89  160      0.026
  77   81   88   86      0.026
  77   81   88  161    179.974
 144   81   88   86    179.974
 144   81   88  161      0.026
 145   81   88   86    179.974
 145   81   88  161      0.026
  18   86   88   81      0.026
  18   86   88  161    179.974
  91   86   88   81    179.974
  91   86   88  161      0.026
  18   86   91   49    179.974
  18   86   91  166      0.026
  18   86   91  167      0.026
  88   86   91   49      0.026
  88   86   91  166    179.974
  88   86   91  167    179.974
  19   87   89   80      0.026
  19   87   89  160    179.974
  90   87   89   80    179.974
  90   87   89  160      0.026
  19   87   90   48    179.974
  19   87   90  168      0.026
  19   87   90  169      0.026
  89   87   90   48      0.026
  89   87   90  168    179.974
  89   87   90  169    179.974


CHIRAL ATOMS
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974
  89   87   90  169    179.974