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2-[2,3-dihydroxy-4-[3-hydroxy-5-(4-hydroxy-3,5-dimethoxy-6-methyl-tetrahydropyran-2-yl)oxy-4-methoxy-6-methyl-tetrahydropyran-2-yl]oxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-dienyl]tetrahydropyran-2-yl]-N-[(2E,4E)-7-[3,4-dihydroxy-5-[(1E,3E,5E)-7-(2-hydroxy-1-
2-[2,3-dihydroxy-4-[3-hydroxy-5-(4-hydroxy-3,5-dimethoxy-6-methyl-tetrahydropyran-2-yl)oxy-4-methoxy-6-methyl-tetrahydropyran-2-yl]oxy-5,5-dimethyl-6-[(1E,3E)-penta-1,3-dienyl]tetrahydropyran-2-yl]-N-[(2E,4E)-7-[3,4-dihydroxy-5-[(1E,3E,5E)-7-(2-hydroxy-1- ID: AN-5621
CAS:56592-32-6
Supplier:AN PharmaTech Co Ltd

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SMILES:O1C(O)(C(O)C(OC2OC(C(OC3OC(C(OC)C(O)C3OC)C)C(OC)C2O)C)C(C1/C=C/C=C/C)(C)C)C(CC)C(=O)NC/C=C/C=C(/C(OC)C(C1OC(C(O)C1O)/C=C/C=C/C=C(\C)/C(=O)c1c(O)n(ccc1=O)C)C)\C	6436033
FORMULA: C59H88N2O20
MASS: 1145.3314
EXACT MASS: 1144.5930432
INTERATOMIC DISTANCES

              O   1      O   2      O   3      O   4      O   5      O   6
              ------------------------------------------------------------------
   O   1    0.0000 
   O   2    3.0000     0.0000 
   O   3    2.6458     2.0000     0.0000 
   O   4    1.9318     3.1196     1.5060     0.0000 
   O   5    3.4641     1.7320     1.0000     2.5036     0.0000 
   O   6    6.0828     4.0000     3.4641     4.7754     2.6458     0.0000 
   O   7    6.2450     3.4641     4.0000     5.5017     3.0000     2.0000 
   O   8    5.0000     2.0000     3.4641     4.8715     2.6457     3.4641 
   O   9    7.0000     4.3589     4.5826     6.0445     3.6055     1.7320 
   O  10    1.2393     4.2342     3.7321     2.6457     4.6252     7.1962 
   O  11    7.9372     6.0000     5.2915     6.4296     4.5826     2.0000 
   O  12    9.6437     6.9282     7.2111     8.6490     6.2450     4.0000 
   O  13    9.5394     7.2111     6.9282     8.2061     6.0828     3.4641 
   O  14    9.4310    12.3584    11.1486     9.6435    12.1471    14.1739 
   O  15   10.1478    13.1478    12.2733    10.8133    13.2638    15.5430 
   O  16   11.7130    14.6907    13.6042    12.1065    14.6041    16.7081 
   O  17    7.6684    10.5627     9.3159     7.8103    10.3138    12.3432 
   O  18   15.9266    18.6400    17.0804    15.6240    18.0278    19.5214 
   O  19   16.6385    19.5246    18.1765    16.6767    19.1618    20.9456 
   O  20   17.6414    20.3326    18.7451    17.2994    19.6836    21.1094 
   N  21    2.5036     5.2780     4.1145     2.6458     5.1112     7.4017 
   N  22   18.2866    21.1466    19.7490    18.2558    20.7272    22.4329 
   C  23    1.7320     1.7321     2.6458     2.9093     3.0000     5.5678 
   C  24    2.0000     1.0001     1.7321     2.3941     2.0000     4.5826 
   C  25    1.7320     1.7321     1.0001     1.4142     1.7321     4.3590 
   C  26    1.0000     2.6458     1.7321     1.0000     2.6458     5.1962 
   C  27    1.0000     2.6458     3.0000     2.7320     3.6055     6.2450 
   C  28    1.4142     3.6327     2.3942     1.0000     3.3859     5.7617 
   C  29    2.7320     1.5060     3.1196     3.7320     3.1623     5.5017 
   C  30    2.3941     2.3942     3.6327     3.8637     3.8982     6.3766 
   C  31    3.6055     1.0000     1.7320     3.1623     1.0000     3.0000 
   C  32    4.5826     1.7320     2.6457     4.1231     1.7320     2.6458 
   C  33    1.7320     3.4641     4.0000     3.6326     4.5826     7.2111 
   C  34    2.3942     4.1145     2.4496     1.0001     3.4253     5.4773 
   C  35    5.2915     2.6457     2.9999     4.5020     2.0000     1.7321 
   C  36    5.1961     2.9999     2.6457     4.0664     1.7320     1.0001 
   C  37    4.3589     2.6457     1.7320     3.0880     1.0000     1.7321 
   C  38    1.5060     4.3198     3.3461     2.0000     4.3198     6.7520 
   C  39    3.1196     5.1112     3.4253     2.0000     4.3814     6.2607 
   C  40    2.0000     4.3590     4.5826     3.8982     5.2915     7.9373 
   C  41    4.5826     3.4641     2.0000     2.9671     1.7320     2.0000 
   C  42    6.9282     4.5826     4.3589     5.7275     3.4641     1.0000 
   C  43    7.8102     5.5677     5.1961     6.4863     4.3589     1.7320 
   C  44    8.6602     6.2449     6.0827     7.4210     5.1961     2.6457 
   C  45    8.7177     6.0827     6.2449     7.6683     5.2915     2.9999 
   C  46    7.9372     5.1961     5.5677     7.0382     4.5826     2.6457 
   C  47    3.0881     6.0267     5.0391     3.6056     6.0267     8.3772 
   C  48    3.0000     5.1962     5.5678     4.8916     6.2450     8.8882 
   C  49    6.5575     3.6055     4.5826     6.0828     3.6056     3.0000 
   C  50    9.1291    12.1037    11.0324     9.5394    12.0319    14.1824 
   C  51    8.1853     5.2915     6.0000     7.5012     5.0000     3.4641 
   C  52    8.2061    11.1938    10.1971     8.7178    11.1938    13.4143 
   C  53    9.9860    12.9754    11.9648    10.4791    12.9629    15.1484 
   C  54   10.7447    13.7150    12.6090    11.1101    13.6090    15.7081 
   C  55   10.4301    13.3582    12.1378    10.6322    13.1356    15.1355 
   C  56    4.0665     6.9654     5.8417     4.3589     6.8400     9.0760 
   C  57    7.4210    10.3845     9.3015     7.8102    10.3007    12.4720 
   C  58    3.6055     6.0828     6.2450     5.3785     7.0000     9.6437 
   C  59    8.1614    11.1611    10.3302     8.8882    11.3152    13.6433 
   C  60    8.8881     6.9999     6.2449     7.3217     5.5677     2.9999 
   C  61    6.4863     9.4679     8.4726     7.0000     9.4679    11.7198 
   C  62    4.7754     7.7448     6.7520     5.2915     7.7448    10.0382 
   C  63    9.8489     7.0000     7.5498     9.0298     6.5575     4.5826 
   C  64   11.0773    13.9571    12.6375    11.1337    13.6286    15.5158 
   C  65    4.5826     6.9282     7.2111     6.3765     7.9372    10.5830 
   C  66    5.7275     8.6705     7.5711     6.0828     8.5700    10.7686 
   C  67    6.4296     9.4292     8.6324     7.2111     9.6111    11.9813 
   C  68   12.0561    14.9470    13.6370    12.1329    14.6283    16.5107 
   C  69    8.6490    11.5224    10.2234     8.7178    11.2177    13.1739 
   C  70   12.7384    15.5810    14.1896    12.6933    15.1717    16.9487 
   C  71   13.7080    16.5644    15.1857    13.6883    16.1688    17.9478 
   C  72   14.4161    17.2260    15.7792    14.2927    16.7517    18.4330 
   C  73   15.3776    18.2030    16.7704    15.2817    17.7446    19.4331 
   C  74   15.6588    18.5365    17.1792    15.6801    18.1638    19.9462 
   C  75   16.1054    18.8866    17.3960    15.9199    18.3592    19.9574 
   C  76   17.0596    19.8574    18.3816    16.9025    19.3471    20.9562 
   C  77   17.3135    20.1635    18.7553    17.2634    19.7324    21.4330 
   C  78   17.8030    20.5590    19.0331    17.5672    19.9875    21.5132 
   C  79   18.7507    21.5240    20.0130    18.5433    20.9702    22.5096 
   C  80   18.9820    21.8068    20.3569    18.8730    21.3262    22.9541 
   C  81   18.6046    21.5043    20.1719    18.6712    21.1583    22.9445 
   H  82    2.5343     0.9341     1.0828     2.2321     1.1500     3.7513 
   H  83    2.5045     1.0828     0.9341     2.1030     1.0828     3.7111 
   H  84    0.9341     3.4601     3.5032     2.8612     4.2394     6.8828 
   H  85    1.8288     3.1818     1.6310     0.1500     2.6306     4.9230 
   H  86    2.8015     0.8902     2.6489     3.4639     2.5816     4.8819 
   H  87    3.3520     1.6788     3.5256     4.2801     3.4094     5.5514 
   H  88    2.8015     2.1242     3.6354     4.0775     3.7556     6.1215 
   H  89    2.8242     2.0632     3.6001     4.0684     3.7041     6.0585 
   H  90    2.9034     2.9035     4.2476     4.4654     4.4768     6.9032 
   H  91    2.0631     2.8243     3.7684     3.7513     4.1762     6.7368 
   H  92    3.9271     0.9341     2.5045     3.8399     1.8500     3.5032 
   H  93    4.0771     1.0828     2.6215     3.9743     1.9294     3.4601 
   H  94    2.2901     3.5191     4.3433     4.1393     4.8212     7.4070 
   H  95    2.9527     4.3177     2.4738     1.2648     3.3805     5.1797 
   H  96    2.2716     3.5627     1.8326     0.4682     2.8052     4.9059 
   H  97    5.9601     3.4601     3.5032     4.9617     2.5343     1.0828 
   H  98    5.9475     3.5032     3.4601     4.9050     2.5045     0.9341 
   H  99    3.7111     2.6215     1.0828     2.2712     0.9341     2.5045 
   H 100    2.8292     2.6200     0.6200     1.2564     1.4158     3.5191 
   H 101    2.4104     2.9306     1.0605     0.6200     2.0126     4.1672 
   H 102    2.7933     5.1044     3.5920     2.0939     4.5811     6.6398 
   H 103    3.6354     5.7298     4.0361     2.6200     4.9828     6.7752 
   H 104    3.5257     5.1926     3.3661     2.0940     4.2632     5.9225 
   H 105    1.7733     4.4727     4.4187     3.5562     5.2101     7.8438 
   H 106    4.0019     3.1995     1.4955     2.3479     1.5200     2.5559 
   H 107    4.8212     4.0130     2.3715     3.0585     2.2901     2.3716 
   H 108    5.1724     3.8121     2.5558     3.5866     2.1114     1.4956 
   H 109    6.9801     4.9267     4.3442     5.5861     3.5669     0.9341 
   H 110    4.7206     1.7732     3.5191     4.8301     2.8292     4.0130 
   H 111    2.8890     5.4713     4.1060     2.6009     5.1044     7.2504 
   H 112    7.1185     5.0766     4.4802     5.7092     3.7111     1.0828 
   H 113    8.7018     6.5017     6.0722     7.3124     5.2652     2.6215 
   H 114    8.8556     6.0722     6.5017     7.9717     5.5156     3.5032 
   H 115    7.3159     4.4802     5.0766     6.5750     4.0771     2.6215 
   H 116    2.5952     5.5793     4.7584     3.4019     5.7248     8.1659 
   H 117    3.3853     6.3747     5.5278     4.1347     6.5024     8.9094 
   H 118    3.3533     5.2331     5.8194     5.2789     6.4222     9.0479 
   H 119    7.1345     4.2047     5.0675     6.5733     4.0751     3.0634 
   H 120    6.8180     3.8242     5.0104     6.4945     4.0601     3.6200 
   H 121    5.9890     3.0148     4.1339     5.6180     3.1879     3.0634 
   H 122    8.5123    11.4604    10.3140     8.8136    11.3139    13.4135 
   H 123    8.7777     5.9014     6.5442     8.0388     5.5456     3.8121 
   H 124    8.3955     5.4428     6.3328     7.8387     5.3371     4.0130 
   H 125    7.5973     4.6841     5.4718     6.9772     4.4738     3.1995 
   H 126    7.4372    10.4335     9.5122     8.0512    10.5038    12.7867 
   H 127    9.2890    12.2866    11.3549     9.8850    12.3487    14.5993 
   H 128   10.9514    13.9433    12.9398    11.4536    13.9379    16.1174 
   H 129   10.1040    12.9821    11.6705    10.1659    12.6629    14.5760 
   H 130   10.0650     7.6540     7.4715     8.7763     6.6018     4.0130 
   H 131    4.3144     7.1130     5.8357     4.3318     6.8349     8.9530 
   H 132    8.2277    11.1749    10.0306     8.5307    11.0306    13.1374 
   H 133    3.4849     6.1648     6.1257     5.1360     6.9386     9.5669 
   H 134    7.5415    10.5412     9.7211     8.2853    10.7042    13.0463 
   H 135    8.1950    11.1858    10.4600     9.0479    11.4338    13.8198 
   H 136    8.7813    11.7810    10.9406     9.4933    11.9271    14.2423 
   H 137    8.7271     7.0274     6.1021     7.0817     5.5055     3.0634 
   H 138    9.4829     7.6200     6.8428     7.8879     6.1810     3.6200 
   H 139    9.0887     7.0273     6.4445     7.6048     5.6972     3.0633 
   H 140    4.7026     7.7002     6.8591     5.4428     7.8383    10.2163 
   H 141   10.4498     7.6142     8.1225     9.5937     7.1345     5.0675 
   H 142   10.0242     7.1151     7.8169     9.3121     6.8180     5.0104 
   H 143    9.2505     6.3870     6.9852     8.4736     5.9890     4.1339 
   H 144   10.9050    13.7415    12.3582    10.8598    13.3427    15.1603 
   H 145    5.9062     8.7896     7.5665     6.0634     8.5660    10.6652 
   H 146    4.5067     6.6399     7.0878     6.3710     7.7564    10.3966 
   H 147    5.1928     7.4716     7.8144     6.9956     8.5255    11.1708 
   H 148    4.7390     7.2581     7.3846     6.4419     8.1612    10.8018 
   H 149   10.7395    13.7391    12.8847    11.4277    13.8741    16.1607 
   H 150   11.9005    14.8915    13.8735    12.3839    14.8722    17.0304 
   H 151    5.8098     8.8093     8.0282     6.6177     9.0038    11.3915 
   H 152    6.4723     9.4584     8.7873     7.4071     9.7505    12.1818 
   H 153    7.0495    10.0491     9.2386     7.8087    10.2200    12.5740 
   H 154   12.2689    15.1912    13.9405    12.4346    14.9361    16.8790 
   H 155    8.7846    11.7044    10.4873     8.9822    11.4858    13.5180 
   H 156    9.2590    12.1207    10.7942     9.2900    11.7860    13.7003 
   H 157    8.5561    11.3714     9.9910     8.4906    10.9782    12.8505 
   H 158   12.5888    15.3881    13.9414    12.4538    14.9153    16.6238 
   H 159   13.8955    16.7852    15.4589    13.9564    16.4477    18.2871 
   H 160   14.2842    17.0517    15.5564    14.0804    16.5199    18.1348 
   H 161   15.0706    17.9588    16.6225    15.1212    17.6098    19.4239 
   H 162   15.8623    18.7671    17.4567    15.9536    18.4463    20.2827 
   H 163   16.2492    19.1168    17.7401    16.2434    18.7220    20.4740 
   H 164   19.2167    21.9656    20.4269    18.9654    21.3774    22.8686 
   H 165   19.5812    22.4130    20.9702    19.4851    21.9406    23.5736 
   H 166   16.8486    19.7594    18.4558    16.9524    19.4456    21.2808 
   H 167   18.0232    20.9316    19.6181    18.1156    20.6066    22.4202 
   H 168   18.8257    21.7462    20.4543    18.9506    21.4447    23.2776 
   H 169   19.1883    22.0796    20.7295    19.2306    21.7136    23.4734 

              O   7      O   8      O   9      O  10      O  11      O  12
              ------------------------------------------------------------------
   O   7    0.0000 
   O   8    2.0000     0.0000 
   O   9    1.0000     3.0000     0.0000 
   O  10    7.4690     6.2335     8.2006     0.0000 
   O  11    3.4641     5.2915     2.6457     8.9840     0.0000 
   O  12    3.4641     5.2915     2.6458    10.8463     3.4641     0.0000 
   O  13    4.0000     6.0000     3.0000    10.6603     2.0000     2.0000 
   O  14   15.1439    14.3266    15.6327     8.2833    15.3943    18.1644 
   O  15   16.2424    15.1477    16.8522     8.9164    16.9689    19.4619 
   O  16   17.6041    16.6802    18.1311    10.5151    17.9675    20.6879 
   O  17   13.3094    12.5199    13.7962     6.5575    13.5921    16.3312 
   O  18   20.8996    20.4933    21.1708    14.9110    20.2461    23.4551 
   O  19   22.1257    21.4660    22.5149    15.5089    21.8968    24.9375 
   O  20   22.5309    22.1708    22.7747    16.6349    21.7646    25.0174 
   N  21    8.1064     7.2284     8.6859     1.7321     8.9582    11.2947 
   N  22   23.6726    23.0730    24.0293    17.1729    23.3080    26.4123 
   C  23    5.1962     3.6055     6.0828     2.8284     7.5498     8.6603 
   C  24    4.3590     3.0000     5.1962     3.2348     6.5575     7.8103 
   C  25    4.5826     3.6056     5.2915     2.9093     6.2450     7.9373 
   C  26    5.5678     4.5826     6.2450     2.0000     7.0000     8.8882 
   C  27    6.0828     4.5826     6.9282     1.8804     8.1853     9.5394 
   C  28    6.3766     5.5372     6.9757     1.7320     7.4294     9.5982 
   C  29    4.7754     2.9671     5.7275     3.8032     7.5012     8.2061 
   C  30    5.7617     3.9664     6.7029     3.2348     8.3740     9.2011 
   C  31    2.6458     1.7320     3.4641     4.8366     5.0000     6.0828 
   C  32    1.7321     1.0000     2.6458     5.8186     4.5826     5.1962 
   C  33    6.9282     5.2915     7.8102     2.0179     9.1651    10.3923 
   C  34    6.3976     5.8645     6.8700     2.6458     6.9668     9.4302 
   C  35    1.0001     1.7320     1.7321     6.5054     3.6056     4.3590 
   C  36    1.7321     2.6457     2.0000     6.3498     3.0000     4.5826 
   C  37    2.6458     3.0000     3.0000     5.4641     3.6055     5.5678 
   C  38    7.2838     6.2919     7.9237     1.0000     8.4293    10.5568 
   C  39    7.3205     6.8595     7.7367     3.0000     7.5982    10.2496 
   C  40    7.8103     6.2450     8.6603     1.6148     9.8489    11.2695 
   C  41    3.4641     4.0000     3.6056     5.5549     3.4641     6.0000 
   C  42    1.7320     3.6056     1.0000     8.0777     1.7320     3.0000 
   C  43    2.6457     4.5826     1.7320     8.9282     1.0000     2.6458 
   C  44    2.9999     5.0000     2.0000     9.8070     1.7320     1.7321 
   C  45    2.6457     4.5826     1.7320     9.9084     2.6457     1.0001 
   C  46    1.7320     3.6055     1.0000     9.1495     3.0000     1.7321 
   C  47    9.0059     8.0111     9.6213     2.0000     9.9552    12.2430 
   C  48    8.6603     7.0000     9.5394     2.4786    10.8166    12.1244 
   C  49    1.0000     1.7321     1.7320     7.7965     4.3589     3.6055 
   C  50   15.0308    14.0927    15.5751     7.9373    15.5067    18.1480 
   C  51    2.0000     3.4641     1.7320     9.4187     4.0000     2.0000 
   C  52   14.1867    13.1887    14.7622     7.0000    14.8075    17.3558 
   C  53   15.9586    14.9706    16.5213     8.7761    16.4933    19.1048 
   C  54   16.6090    15.7015    17.1324     9.5550    16.9724    19.6879 
   C  55   16.1307    15.3257    16.6090     9.2791    16.3218    19.1300 
   C  56    9.8370     8.9352    10.4034     3.0000    10.5499    13.0006 
   C  57   13.2993    12.3699    13.8491     6.2450    13.8350    16.4288 
   C  58    9.5394     7.9372    10.3923     2.7712    11.5325    13.0000 
   C  59   14.2827    13.1609    14.9127     6.9282    15.1302    17.5335 
   C  60    4.3589     6.2450     3.4641     9.9084     1.0000     3.6056 
   C  61   12.4584    11.4610    13.0437     5.2915    13.1609    15.6455 
   C  62   10.7312     9.7348    11.3294     3.6056    11.5394    13.9404 
   C  63    3.6055     5.1962     3.0000    11.0744     4.3589     1.0000 
   C  64   16.6082    15.9017    17.0387     9.9630    16.6044    19.5158 
   C  65   10.3923     8.7177    11.2694     3.7703    12.4899    13.8564 
   C  66   11.5680    10.6501    12.1250     4.5826    12.1801    14.7126 
   C  67   12.5676    11.4290    13.2138     5.1962    13.5230    15.8423 
   C  68   17.6082    16.8953    18.0374    10.9309    17.5841    20.5107 
   C  69   14.2056    13.4687    14.6627     7.5499    14.3507    17.1707 
   C  70   18.1296    17.5053    18.5150    11.6466    17.9305    20.9427 
   C  71   19.1285    18.4939    19.5150    12.6041    18.9208    21.9412 
   C  72   19.6857    19.1313    20.0322    13.3425    19.3209    22.4125 
   C  73   20.6821    20.1146    21.0314    14.2914    20.3173    23.4125 
   C  74   21.1265    20.4744    21.5149    14.5363    20.9040    23.9386 
   C  75   21.2692    20.7745    21.5818    15.0467    20.7627    23.9176 
   C  76   22.2620    21.7525    22.5789    15.9883    21.7620    24.9174 
   C  77   22.6755    22.0856    23.0299    16.2076    22.3108    25.4123 
   C  78   22.8741    22.4311    23.1573    16.7566    22.2460    25.4516 
   C  79   23.8630    23.4039    24.1514    17.6919    23.2460    26.4500 
   C  80   24.2493    23.7139    24.5736    17.8904    23.7606    26.9168 
   C  81   24.1243    23.4515    24.5150    17.4635    23.8842    26.9356 
   H  82    3.7111     2.6781     4.4802     3.7592     5.7159     7.1185 
   H  83    3.7513     2.7879     4.4969     3.7191     5.6632     7.1395 
   H  84    6.8609     5.4196     7.6761     1.1463     8.7790    10.3040 
   H  85    5.6302     4.9642     6.1828     2.5045     6.5796     8.7906 
   H  86    4.1963     2.4675     5.1351     3.9694     6.8813     7.6436 
   H  87    4.6051     2.6845     5.5863     4.4131     7.5378     7.9747 
   H  88    5.3636     3.5054     6.3252     3.7337     8.1211     8.7763 
   H  89    5.2916     3.4317     6.2541     3.7731     8.0579     8.7032 
   H  90    6.1679     4.2930     7.1308     3.6050     8.9031     9.5736 
   H  91    6.2578     4.5228     7.1772     2.7314     8.7228     9.7131 
   H  92    2.6216     1.0828     3.5669     5.1638     5.4747     6.0723 
   H  93    2.5045     0.9341     3.4601     5.3136     5.4196     5.9475 
   H  94    6.9559     5.2100     7.8743     2.6337     9.3863    10.4108 
   H  95    6.2731     5.9378     6.6632     3.2657     6.5515     9.1685 
   H  96    5.7794     5.2644     6.2646     2.8114     6.4618     8.8381 
   H  97    0.9341     2.5045     1.0828     7.1476     2.7879     3.7111 
   H  98    1.0828     2.6216     1.1500     7.1266     2.6781     3.7513 
   H  99    3.4601     3.5032     3.8500     4.7471     4.2394     6.4088 
   H 100    4.3433     4.0130     4.8212     3.7832     5.2100     7.4070 
   H 101    4.9829     4.5211     5.4794     3.2380     5.8097     8.0666 
   H 102    7.5657     6.9443     8.0465     2.4825     8.0686    10.6030 
   H 103    7.9021     7.4770     8.2892     3.3533     8.0273    10.7729 
   H 104    7.1209     6.8302     7.4656     3.5505     7.1506     9.9223 
   H 105    7.8744     6.4222     8.6825     1.0640     9.7100    11.3140 
   H 106    3.8121     4.0478     4.0751     4.9462     4.0841     6.5443 
   H 107    4.0131     4.6200     4.0601     5.6992     3.5191     6.3328 
   H 108    3.1995     4.0478     3.1879     6.1657     2.8441     5.4719 
   H 109    2.5045     4.2394     1.8500     8.0698     1.0828     3.5032 
   H 110    2.6200     0.6200     3.6200     5.9358     5.8808     5.8809 
   H 111    8.1021     7.3707     8.6199     2.2901     8.7111    11.1961 
   H 112    2.6215     4.3787     1.9294     8.2031     0.9341     3.4601 
   H 113    3.5032     5.4747     2.5342     9.8005     1.0828     2.5045 
   H 114    2.6215     4.3786     1.9293    10.0722     3.4601     0.9341 
   H 115    1.0828     2.7879     0.9341     8.5435     3.5032     2.5045 
   H 116    8.6699     7.5757     9.3303     1.4332     9.8213    11.9669 
   H 117    9.4582     8.3718    10.1066     2.1943    10.5237    12.7389 
   H 118    8.6825     6.9386     9.5919     3.0013    11.0047    12.1402 
   H 119    1.1766     2.3521     1.5200     8.3722     4.1517     3.0148 
   H 120    1.6200     1.8397     2.2901     8.0554     4.9340     3.8242 
   H 121    1.1766     1.1121     2.1114     7.2282     4.6402     4.2047 
   H 122   14.3138    13.4385    14.8334     7.3485    14.7042    17.3906 
   H 123    2.5558     4.0841     2.1114    10.0084     4.0478     1.4956 
   H 124    2.3715     3.5191     2.2901     9.6342     4.6200     2.3716 
   H 125    1.4955     2.8441     1.5200     8.8332     4.0478     2.5559 
   H 126   13.4861    12.4320    14.0902     6.2187    14.2414    16.7001 
   H 127   15.3352    14.2856    15.9283     8.0666    16.0070    18.5303 
   H 128   16.9336    15.9395    17.4953     9.7375    17.4485    20.0769 
   H 129   15.6459    14.9275    16.0865     8.9944    15.6978    18.5756 
   H 130    4.3433     6.3328     3.3533    11.2015     2.6200     1.7732 
   H 131    9.8334     9.0507    10.3483     3.3533    10.3410    12.9150 
   H 132   14.0305    13.1529    14.5528     7.0656    14.4377    17.1124 
   H 133    9.5919     8.0774    10.4108     2.4907    11.4142    13.0386 
   H 134   13.6683    12.5410    14.3036     6.3082    14.5516    16.9272 
   H 135   14.3769    13.1818    15.0386     6.9559    15.3596    17.6711 
   H 136   14.8976    13.7809    15.5226     7.5482    15.7119    18.1407 
   H 137    4.6403     6.4446     3.8121     9.7005     1.1766     4.2048 
   H 138    4.9340     6.8429     4.0130    10.4886     1.6200     3.8242 
   H 139    4.1517     6.1022     3.1995    10.1500     1.1766     3.0148 
   H 140   10.7990     9.6993    11.4406     3.4849    11.7861    14.0692 
   H 141    4.2047     5.8162     3.5505    11.6724     4.6403     1.1766 
   H 142    3.8242     5.2331     3.3533    11.2582     4.9340     1.6200 
   H 143    3.0148     4.5762     2.4825    10.4789     4.1517     1.1766 
   H 144   16.3075    15.6663    16.7089     9.8239    16.1968    19.1584 
   H 145   11.5650    10.7473    12.0777     4.8213    11.9995    14.6371 
   H 146   10.0966     8.3630    10.9973     3.8426    12.3324    13.5570 
   H 147   10.9337     9.2230    11.8231     4.3900    13.0868    14.3967 
   H 148   10.7158     9.1009    11.5684     3.7991    12.6759    14.1766 
   H 149   16.8498    15.7388    17.4647     9.5057    17.5890    20.0766 
   H 150   17.8695    16.8872    18.4225    10.6874    18.3349    20.9971 
   H 151   11.9548    10.8091    12.6078     4.5762    12.9555    15.2391 
   H 152   12.6745    11.4531    13.3557     5.2330    13.7791    15.9945 
   H 153   13.1810    12.0489    13.8209     5.8161    14.0949    16.4466 
   H 154   17.9258    17.1543    18.3811    11.1188    17.9989    20.8781 
   H 155   14.4826    13.6701    14.9727     7.6458    14.7515    17.5071 
   H 156   14.7680    14.0606    15.2082     8.1660    14.8354    17.6996 
   H 157   13.9508    13.2932    14.3729     7.5041    13.9659    16.8504 
   H 158   17.8545    17.2917    18.2119    11.5277    17.5536    20.6100 
   H 159   19.4212    18.7308    19.8331    12.7674    19.3069    22.2851 
   H 160   19.4327    18.9361    19.7524    13.2389    18.9716    22.1021 
   H 161   20.5791    19.9026    20.9807    13.9417    20.4125    23.4196 
   H 162   21.4209    20.7187    21.8324    14.7204    21.2833    24.2798 
   H 163   21.6778    21.0490    22.0536    15.1330    21.4021    24.4623 
   H 164   24.2528    23.8318    24.5218    18.1721    23.5629    26.7939 
   H 165   24.8658    24.3232    25.1923    18.4843    24.3803    27.5368 
   H 166   22.4208    21.7133    22.8320    15.7013    22.2731    25.2774 
   H 167   23.5782    22.8837    23.9804    16.8765    23.3865    26.4145 
   H 168   24.4206    23.7042    24.8315    17.6696    24.2552    27.2733 
   H 169   24.6738    24.0218    25.0533    18.0525    24.3874    27.4606 

              O  13      O  14      O  15      O  16      O  17      O  18
              ------------------------------------------------------------------
   O  13    0.0000 
   O  14   17.3640     0.0000 
   O  15   18.8822     2.5875     0.0000 
   O  16   19.9310     2.5876     2.1756     0.0000 
   O  17   15.5539     1.8366     3.7188     4.3772     0.0000 
   O  18   22.2358     7.0609     8.3726     6.2788     8.4583     0.0000 
   O  19   23.8967     7.2316     7.5766     5.4260     8.9714     3.0000 
   O  20   23.7451     8.7761     9.9629     7.8237    10.1903     1.7320 
   N  21   10.8001     7.1027     8.1679     9.5082     5.2915    13.4372 
   N  22   25.3071     8.9140     9.3040     7.1574    10.6201     3.4641 
   C  23    8.8882    11.1097    11.6785    13.3332     9.3694    17.6571 
   C  24    7.9373    11.3784    12.1477    13.6970     9.5907    17.7252 
   C  25    7.8103    10.7354    11.6813    13.1239     8.9212    16.9213 
   C  26    8.6603     9.7461    10.6844    12.1256     7.9373    16.0021 
   C  27    9.6437    10.1570    10.6814    12.3518     8.4378    16.7783 
   C  28    9.2011     8.8211     9.8792    11.2399     7.0000    15.0082 
   C  29    8.6490    12.0857    12.5860    14.2805    10.3561    18.6564 
   C  30    9.5982    11.4402    11.7933    13.5536     9.7596    18.1438 
   C  31    6.2450    12.7190    13.6764    15.1213    10.8980    18.7845 
   C  32    5.5678    13.7125    14.6744    16.1201    11.8893    19.7261 
   C  33   10.5830    10.0061    10.2914    12.0719     8.3667    16.7959 
   C  34    8.8318     8.7648    10.0682    11.2637     6.9282    14.6385 
   C  35    4.5826    14.1448    15.2485    16.6040    12.3106    19.9381 
   C  36    4.3590    13.6329    14.8796    16.1345    11.7965    19.2269 
   C  37    5.1962    12.6331    13.8963    15.1366    10.7967    18.2596 
   C  38   10.1971     8.0389     8.9595    10.3973     6.2450    14.4354 
   C  39    9.5216     7.9149     9.3708    10.4487     6.0828    13.6552 
   C  40   11.3579     9.1027     9.3068    11.1141     7.5108    15.9636 
   C  41    5.2915    12.1809    13.6012    14.7223    10.3526    17.5658 
   C  42    2.6458    15.1711    16.5191    17.7022    13.3395    20.5024 
   C  43    1.7321    15.7544    17.2064    18.3085    13.9334    20.8508 
   C  44    1.0001    16.7470    18.1756    19.2979    14.9240    21.8408 
   C  45    1.7321    17.1663    18.4789    19.6921    15.3336    22.4694 
   C  46    2.6458    16.6325    17.8407    19.1297    14.7961    22.1464 
   C  47   11.7882     6.3452     7.2379     8.6703     4.5826    12.9110 
   C  48   12.2882     9.1004     9.0242    10.9402     7.6299    16.0757 
   C  49    4.5826    15.7022    16.6713    18.1183    13.8756    21.6252 
   C  50   17.4518     0.9999     1.7820     2.5876     2.0000     7.8623 
   C  51    3.4641    17.1424    18.2320    19.6040    15.3074    22.8324 
   C  52   16.7304     1.7820     2.1755     3.5202     1.7321     8.8113 
   C  53   18.4334     1.6180     0.9999     1.7821     2.9963     7.6388 
   C  54   18.9341     1.6180     1.7819     1.0001     3.3804     6.6522 
   C  55   18.2986     0.9999     2.5875     1.7820     2.8219     6.2450 
   C  56   12.4348     5.3932     6.4676     7.7768     3.6056    11.9110 
   C  57   15.7666     2.0886     3.1718     4.3155     1.0001     9.0831 
   C  58   13.0767     8.2799     8.0710    10.0240     6.9013    15.3025 
   C  59   17.0166     2.6767     1.9908     3.8543     2.6458     9.5706 
   C  60    1.7321    16.0631    17.7235    18.6458    14.2808    20.6715 
   C  61   15.0640     3.0883     3.8233     5.2268     1.7321    10.0660 
   C  62   13.4143     4.6797     5.5229     6.9460     3.0000    11.4459 
   C  63    3.0000    18.6324    19.8213    21.1272    16.7959    24.1038 
   C  64   18.5950     1.7821     3.5201     2.1756     3.4093     5.2914 
   C  65   14.0000     8.4566     7.9348     9.9822     7.2410    15.5163 
   C  66   14.0927     3.7046     4.7901     6.0458     2.0000    10.4493 
   C  67   15.3813     3.6779     3.7213     5.4574     2.6458    10.7369 
   C  68   19.5766     2.6767     3.8542     1.9908     4.3891     4.5825 
   C  69   16.3274     1.0943     3.5032     3.6693     1.0000     7.4646 
   C  70   19.9292     3.5129     4.8529     2.9191     5.0916     3.6055 
   C  71   20.9199     4.3965     5.3865     3.2789     6.0469     2.9999 
   C  72   21.3206     5.2445     6.3804     4.2789     6.7988     2.0000 
   C  73   22.3169     6.1233     7.0124     4.8517     7.7373     1.7320 
   C  74   22.9037     6.2695     6.7780     4.6055     7.9903     2.6457 
   C  75   22.7590     6.9763     7.9918     5.8392     8.5161     0.9999 
   C  76   23.7580     7.8523     8.6795     6.5059     9.4428     1.7321 
   C  77   24.3101     7.9669     8.4912     6.3244     9.6512     2.6457 
   C  78   24.2357     8.7083     9.6451     7.4756    10.2384     2.0000 
   C  79   25.2357     9.5824    10.3679     8.1923    11.1564     3.0000 
   C  80   25.7562     9.6766    10.2108     8.0490    11.3334     3.6055 
   C  81   25.8843     9.1801     9.2916     7.2043    10.9439     4.3589 
   H  82    7.1395    11.6695    12.5954    14.0550     9.8550    17.8271 
   H  83    7.1185    11.5777    12.5291    13.9727     9.7603    17.7095 
   H  84   10.3186     9.3549     9.8343    11.5201     7.6596    16.0425 
   H  85    8.3553     9.5180    10.6724    11.9752     7.6859    15.5290 
   H  86    8.0405    12.2301    12.8493    14.4843    10.4697    18.6900 
   H  87    8.5561    12.6927    13.1554    14.8713    10.9691    19.2759 
   H  88    9.2590    11.9718    12.3484    14.1010    10.2787    18.6432 
   H  89    9.1897    12.0185    12.4060    14.1539    10.3217    18.6805 
   H  90   10.0631    11.6834    11.9061    13.7251    10.0439    18.4662 
   H  91   10.0284    10.8665    11.1814    12.9552     9.2048    17.6124 
   H  92    6.5018    13.2450    14.0735    15.5978    11.4400    19.4449 
   H  93    6.4088    13.3929    14.2235    15.7471    11.5871    19.5843 
   H  94   10.7175    10.5149    10.6971    12.5254     8.9055    17.3492 
   H  95    8.4580     8.9961    10.4250    11.5290     7.1640    14.6529 
   H  96    8.2932     9.3760    10.6389    11.8665     7.5396    15.2497 
   H  97    3.7513    14.5563    15.7701    17.0508    12.7197    20.1557 
   H  98    3.7111    14.4828    15.7172    16.9830    12.6464    20.0518 
   H  99    5.9475    11.7833    13.0625    14.2886     9.9470    17.4402 
   H 100    6.9559    10.8213    12.0568    13.3105     8.9848    16.6161 
   H 101    7.5899    10.1695    11.3980    12.6537     8.3334    16.0252 
   H 102    9.9635     7.5889     8.9202    10.0880     5.7523    13.5521 
   H 103    9.9757     7.4069     8.9672     9.9603     5.5843    13.0468 
   H 104    9.1006     8.2747     9.8397    10.8329     6.4560    13.7853 
   H 105   11.2927     8.5912     8.9156    10.6657     6.9637    15.4056 
   H 106    5.9015    11.6210    13.0038    14.1524     9.7891    17.1158 
   H 107    5.4429    11.9341    13.4524    14.4941    10.1172    17.1509 
   H 108    4.6842    12.7464    14.2006    15.2960    10.9223    18.0259 
   H 109    2.6216    14.8205    16.2790    17.3745    12.9993    19.9561 
   H 110    6.6200    14.1213    14.8468    16.4328    12.3309    20.4055 
   H 111   10.5961     7.0427     8.2955     9.5134     5.2100    13.1730 
   H 112    2.5045    14.9115    16.3854    17.4685    13.0924    20.0102 
   H 113    0.9341    16.4301    17.9577    18.9978    14.6207    21.3288 
   H 114    2.5045    17.5597    18.7747    20.0603    15.7234    23.0244 
   H 115    3.4601    16.2135    17.3251    18.6804    14.3781    21.9041 
   H 116   11.6069     6.8543     7.5932     9.1182     5.1245    13.4957 
   H 117   12.3369     6.0952     6.7975     8.3288     4.3998    12.8192 
   H 118   12.4043     9.6570     9.4843    11.4386     8.2173    16.6530 
   H 119    4.1339    16.2111    17.2262    18.6453    14.3806    22.0493 
   H 120    5.0104    16.0698    16.9613    18.4572    14.2506    22.0858 
   H 121    5.0675    15.2014    16.1211    17.5975    13.3803    21.2107 
   H 122   16.6574     0.9750     2.6036     3.2981     1.1521     8.0175 
   H 123    3.1995    17.6706    18.7980    20.1453    15.8345    23.2807 
   H 124    4.0131    17.4797    18.4976    19.9176    15.6481    23.2691 
   H 125    3.8121    16.6204    17.6696    19.0674    14.7875    22.3923 
   H 126   16.1405     2.5685     2.7621     4.3366     1.9294     9.6260 
   H 127   17.9261     1.9418     0.9750     2.6037     2.7767     8.4524 
   H 128   19.3934     2.2990     1.2029     0.9751     3.9016     7.1960 
   H 129   17.6839     0.9751     3.2981     2.6037     2.4377     6.1412 
   H 130    0.6200    17.9759    19.4788    20.5411    16.1639    22.8530 
   H 131   12.2580     5.3139     6.6281     7.7831     3.4849    11.6122 
   H 132   16.3881     1.2391     2.7854     3.5784     0.9341     8.2507 
   H 133   13.0202     7.7139     7.6167     9.5244     6.3015    14.7194 
   H 134   16.4290     2.9585     2.6100     4.4169     2.5121     9.9692 
   H 135   17.2209     3.2622     2.1191     4.1698     3.2380    10.0625 
   H 136   17.6065     2.5190     1.3723     3.3122     2.9083     9.1965 
   H 137    2.3521    15.6179    17.3321    18.2038    13.8493    20.1182 
   H 138    1.8397    16.4948    18.2034    19.0806    14.7258    20.9550 
   H 139    1.1121    16.5197    18.1277    19.0977    14.7257    21.2284 
   H 140   13.6271     4.9130     5.4580     7.0384     3.3533    11.8079 
   H 141    3.0634    19.1756    20.3958    21.6801    17.3397    24.5726 
   H 142    3.6200    18.9432    20.0659    21.4186    17.1070    24.5179 
   H 143    3.0634    18.0941    19.2496    20.5782    16.2575    23.6420 
   H 144   18.1918     1.9173     4.0024     2.7929     3.2832     5.2099 
   H 145   13.9370     3.5882     5.0046     6.0538     1.7732    10.1072 
   H 146   13.7819     9.0605     8.5532    10.6022     7.8129    16.1182 
   H 147   14.5776     8.6227     7.9128    10.0065     7.5109    15.6795 
   H 148   14.2417     7.8551     7.3166     9.3622     6.6775    14.9159 
   H 149   19.5019     3.0316     0.6200     2.0050     4.3004     8.2830 
   H 150   20.2878     3.0317     2.0051     0.6200     4.7527     6.7114 
   H 151   14.8013     4.1548     4.3410     6.0485     2.9083    11.1901 
   H 152   15.6070     4.1236     3.7914     5.6846     3.2380    11.1776 
   H 153   15.9643     3.2496     3.1017     4.8734     2.5121    10.3012 
   H 154   19.9865     2.8379     3.5518     1.5116     4.6365     4.8212 
   H 155   16.7180     0.6614     2.8856     3.2175     1.1766     7.5639 
   H 156   16.8190     0.9236     3.5087     3.3071     1.6199     6.8495 
   H 157   15.9515     1.6512     4.1215     4.1647     1.1766     7.4160 
   H 158   19.5535     3.5833     5.2132     3.4041     5.0079     3.4849 
   H 159   21.3040     4.4965     5.1745     3.0121     6.2288     3.3532 
   H 160   20.9700     5.2920     6.6587     4.6235     6.7365     1.7732 
   H 161   22.4114     5.6670     6.1673     3.9930     7.4037     2.9083 
   H 162   23.2818     6.4371     6.7039     4.5578     8.2048     3.2379 
   H 163   23.4022     6.8751     7.3903     5.2198     8.5816     2.5121 
   H 164   25.5477    10.1112    10.9585     8.7832    11.6533     3.3533 
   H 165   26.3758    10.2555    10.7170     8.5659    11.9268     4.2101 
   H 166   24.2720     7.4192     7.5515     5.4427     9.1967     3.6200 
   H 167   25.3863     8.5943     8.6721     6.5889    10.3691     4.1517 
   H 168   26.2548     9.3948     9.3378     7.3023    11.1849     4.9340 
   H 169   26.3873     9.7702     9.9111     7.8204    11.5234     4.6402 

              O  19      O  20      N  21      N  22      C  23      C  24
              ------------------------------------------------------------------
   O  19    0.0000 
   O  20    3.4641     0.0000 
   N  21   14.2468    15.1478     0.0000 
   N  22    1.7320     3.0000    15.8705     0.0000 
   C  23   18.3315    19.3727     4.2342    19.9893     0.0000 
   C  24   18.5585    19.4255     4.3198    20.1887     1.0000     0.0000 
   C  25   17.8607    18.6099     3.6327    19.4681     1.7320     1.0000 
   C  26   16.8884    17.6993     2.6458    18.5045     2.0000     1.7320 
   C  27   17.3855    18.4996     3.4253    19.0520     1.0000     1.7320 
   C  28   15.9301    16.7032     1.7321    17.5363     2.9093     2.7320 
   C  29   19.3121    20.3723     5.2338    20.9745     1.0000     1.4142 
   C  30   18.6711    19.8686     4.8366    20.3513     1.0000     1.9318 
   C  31   19.8138    20.4564     5.6204    21.4054     2.6458     1.7321 
   C  32   20.7937    21.3899     6.6170    22.3782     3.4641     2.6458 
   C  33   17.2302    18.5254     3.7417    18.9200     1.7320     2.6457 
   C  34   15.7373    16.3095     2.0000    17.3026     3.7321     3.3461 
   C  35   21.1365    21.5772     7.1075    22.6892     4.3589     3.4641 
   C  36   20.5265    20.8460     6.7121    22.0504     4.5826     3.6055 
   C  37   19.5333    19.8869     5.7321    21.0625     4.0000     3.0000 
   C  38   15.2126    16.1470     1.0001    16.8454     3.2348     3.3460 
   C  39   14.8059    15.3211     1.7320    16.3550     4.6252     4.3198 
   C  40   16.3122    17.6953     3.2870    18.0103     2.6458     3.4641 
   C  41   18.9509    19.1696     5.5129    20.4463     4.5826     3.6056 
   C  42   21.9433    22.0833     8.3655    23.4271     6.2450     5.2915 
   C  43   22.4027    22.3990     9.0947    23.8504     7.2111     6.2450 
   C  44   23.4024    23.3834    10.0453    24.8482     7.9372     7.0000 
   C  45   23.9392    24.0375    10.3137    25.4168     7.8102     6.9282 
   C  46   23.5098    23.7435     9.6768    25.0200     6.9282     6.0828 
   C  47   13.5509    14.6350     1.0000    15.2025     4.7884     5.0391 
   C  48   16.2392    17.8066     4.0090    17.9543     3.4641     4.3589 
   C  49   22.7587    23.2736     8.6127    24.3305     5.2915     4.5826 
   C  50    7.7328     9.5550     6.9282     9.4488    10.7604    11.1106 
   C  51   24.1065    24.4494    10.1047    25.6433     7.0000     6.2450 
   C  52    8.7320    10.5150     6.0827    10.4487     9.8143    10.1971 
   C  53    7.1510     9.2791     7.8523     8.8819    11.5845    11.9783 
   C  54    6.1874     8.2833     8.5175     7.9149    12.3783    12.7233 
   C  55    6.2450     7.9373     8.1006     7.9373    12.1063    12.3783 
   C  56   12.5769    13.6351     1.7320    14.2205     5.7786     5.9880 
   C  57    9.3055    10.8092     5.1961    10.9968     9.0730     9.3940 
   C  58   15.3597    17.0297     3.9844    17.0811     4.3589     5.1961 
   C  59    9.2386    11.2499     6.2450    10.9688     9.6880    10.1611 
   C  60   22.4242    22.1528     9.7969    23.7966     8.5440     7.5498 
   C  61   10.2976    11.7943     4.3589    11.9926     8.1152     8.4726 
   C  62   11.9094    13.1774     2.6457    13.5820     6.4337     6.7519 
   C  63   25.5008    25.6883    11.6634    27.0034     8.7178     7.9373 
   C  64    5.5677     6.9999     8.6795     7.2110    12.7782    12.9911 
   C  65   15.3800    17.2326     4.9136    17.1100     5.1961     6.0827 
   C  66   10.9264    12.1811     3.4641    12.5927     7.4065     7.6845 
   C  67   10.7305    12.4539     4.5826    12.4484     7.9619     8.4293 
   C  68    4.5825     6.2449     9.6705     6.2449    13.7511    13.9782 
   C  69    8.0024     9.1965     6.2450     9.6381    10.3561    10.5567 
   C  70    3.9999     5.2914    10.3069     5.5677    14.4503    14.6265 
   C  71    2.9999     4.5825    11.2880     4.5825    15.4149    15.6063 
   C  72    2.6458     3.6055    11.9637     4.0000    16.1350    16.2818 
   C  73    1.7320     2.9999    12.9351     2.9999    17.0923    17.2546 
   C  74    1.0000     3.6055    13.2585     2.6458    17.3561    17.5726 
   C  75    2.0000     2.0000    13.6393     2.6458    17.8288    17.9517 
   C  76    1.7320     1.7320    14.6019     1.7320    18.7797    18.9179 
   C  77    1.0000     2.6457    14.8891     1.0000    19.0201    19.2084 
   C  78    2.6458     0.9999    15.3274     2.0000    19.5293    19.6323 
   C  79    3.0000     1.7320    16.2823     1.7321    20.4744    20.5925 
   C  80    2.6457     2.6457    16.5404     1.0000    20.6952    20.8597 
   C  81    2.0001     4.0000    16.2279     1.0000    20.2895    20.5345 
   H  82   18.7913    19.5106     4.5668    20.3954     1.8500     0.8501 
   H  83   18.6896    19.3910     4.4762    20.2900     1.9294     0.9341 
   H  84   16.5863    17.7680     2.8352    18.2606     1.8500     2.5044 
   H  85   16.5630    17.2076     2.5045    18.1462     2.8873     2.4216 
   H  86   19.4400    20.3977     5.2546    21.0870     1.1766     1.0697 
   H  87   19.9210    20.9921     5.8536    21.5860     1.6199     1.9037 
   H  88   19.2033    20.3658     5.2861    20.8798     1.1766     1.9037 
   H  89   19.2501    20.4025     5.3140    20.9252     1.1766     1.8699 
   H  90   18.9052    20.1947     5.2711    20.5969     1.6199     2.5357 
   H  91   18.0949    19.3397     4.3949    19.7801     1.1766     2.1763 
   H  92   20.3902    21.1282     6.1487    22.0013     2.6216     1.9294 
   H  93   20.5361    21.2664     6.2957    22.1460     2.7609     2.0791 
   H  94   17.7274    19.0800     4.3603    19.4244     1.8396     2.8291 
   H  95   15.8638    16.3044     2.5069    17.4007     4.1578     3.6516 
   H  96   16.3573    16.9175     2.5069    17.9223     3.3672     2.8604 
   H  97   21.4604    21.7713     7.6034    22.9845     5.1501     4.2217 
   H  98   21.3714    21.6642     7.5494    22.8910     5.1791     4.2395 
   H  99   18.6896    19.0751     4.9054    20.2237     3.6500     2.6782 
   H 100   17.7835    18.2694     3.8943    19.3372     3.1408     2.2901 
   H 101   17.1526    17.6874     3.2380    18.7149     3.0771     2.3796 
   H 102   14.5846    15.2367     1.1121    16.1619     4.4117     4.2392 
   H 103   14.2331    14.7090     1.8396    15.7707     5.1985     4.9287 
   H 104   15.0494    15.4299     2.3520    16.5690     4.9082     4.4854 
   H 105   15.8144    17.1364     2.6797    17.5048     2.8292     3.5191 
   H 106   18.4426    18.7348     4.8991    19.9542     4.1339     3.1879 
   H 107   18.6076    18.7378     5.4652    20.0797     5.0104     4.0601 
   H 108   19.4656    19.6143     6.1280    20.9451     5.0675     4.0751 
   H 109   21.4820    21.5146     8.1798    22.9371     6.5018     5.5157 
   H 110   21.2956    22.0949     7.0498    22.9194     3.2070     2.7431 
   H 111   14.1051    14.8716     0.6200    15.7032     4.5913     4.5540 
   H 112   21.5530    21.5635     8.2957    23.0024     6.6500     5.6633 
   H 113   22.9705    22.8471     9.8912    24.3868     8.1408     7.1709 
   H 114   24.4184    24.6118    10.6108    25.9206     7.8021     6.9801 
   H 115   23.1725    23.5242     9.1865    24.7095     6.2067     5.4058 
   H 116   14.0772    15.2220     1.0812    15.7398     4.2555     4.5823 
   H 117   13.3250    14.5490     1.5967    14.9965     5.0225     5.3768 
   H 118   16.7658    18.3829     4.5918    18.4851     3.5191     4.4726 
   H 119   23.2353    23.6867     9.1371    24.7945     5.9015     5.1725 
   H 120   23.1642    23.7436     8.9683    24.7498     5.4429     4.8213 
   H 121   22.2891    22.8699     8.1018    23.8735     4.6842     4.0019 
   H 122    8.1868     9.7374     6.2326     9.8773    10.1768    10.4744 
   H 123   24.6007    24.8861    10.6565    26.1251     7.6142     6.8485 
   H 124   24.4897    24.8972    10.4095    26.0415     7.1151     6.4222 
   H 125   23.6183    24.0208     9.5613    25.1675     6.3870     5.6451 
   H 126    9.5813    11.3365     5.4058    11.2985     9.0193     9.4344 
   H 127    7.9976    10.1061     7.2426     9.7290    10.8562    11.2872 
   H 128    6.3945     8.7697     8.8273     8.1249    12.5398    12.9455 
   H 129    6.5427     7.8656     7.7046     8.1830    11.8070    12.0161 
   H 130   24.5166    24.3597    11.3819    25.9268     9.3512     8.4158 
   H 131   12.4161    13.3276     1.8396    14.0336     6.0452     6.1591 
   H 132    8.4635     9.9741     5.9475    10.1508     9.8938    10.1890 
   H 133   14.8300    16.4482     3.5003    16.5472     4.4726     5.2330 
   H 134    9.7635    11.6656     5.6451    11.4903     9.0699     9.5412 
   H 135    9.5916    11.7252     6.4222    11.3237     9.6609    10.1882 
   H 136    8.7261    10.8537     6.8484    10.4581    10.3063    10.7810 
   H 137   21.9063    21.5880     9.4891    23.2634     8.5036     7.5041 
   H 138   22.7672    22.4125    10.3315    24.1154     9.1611     8.1661 
   H 139   22.9471    22.7204    10.1334    24.3339     8.6289     7.6458 
   H 140   12.1344    13.5397     2.8292    13.8254     6.2952     6.7007 
   H 141   26.0098    26.1454    12.2327    27.5005     9.3340     8.5470 
   H 142   25.8633    26.1148    11.9284    27.3819     8.8105     8.0775 
   H 143   24.9969    25.2382    11.0996    26.5116     8.1022     7.3294 
   H 144    5.8192     6.9385     8.4679     7.4070    12.6203    12.7876 
   H 145   10.7408    11.8357     3.5192    12.3811     7.6164     7.8186 
   H 146   15.9992    17.8364     5.1531    17.7289     4.9155     5.8448 
   H 147   15.4252    17.3861     5.5022    17.1571     5.7415     6.6486 
   H 148   14.7609    16.6299     4.7436    16.4910     5.5322     6.3722 
   H 149    7.2735     9.8237     8.7820     8.9889    12.2550    12.7391 
   H 150    5.6055     8.2022     9.7633     7.3250    13.4898    13.8940 
   H 151   11.2813    12.9141     4.0019    12.9932     7.3448     7.8094 
   H 152   11.0360    12.8849     4.8212    12.7622     7.9290     8.4619 
   H 153   10.1878    12.0081     5.1724    11.9110     8.5795     9.0492 
   H 154    4.4186     6.4221     9.9265     6.1257    13.9460    14.2135 
   H 155    7.8632     9.2894     6.4445     9.5347    10.4697    10.7261 
   H 156    7.4057     8.5811     6.8428     9.0312    10.9691    11.1587 
   H 157    8.1862     9.1448     6.1022     9.7798    10.2787    10.4215 
   H 158    4.3433     5.2100    10.1293     5.8193    14.3108    14.4460 
   H 159    2.7430     4.8212    11.5080     4.4186    15.5891    15.8173 
   H 160    3.1408     3.4848    11.8111     4.3433    16.0102    16.1199 
   H 161    1.5679     4.0750    12.6813     3.2567    16.7638    16.9917 
   H 162    0.8742     4.0600    13.4924     2.6008    17.5464    17.7953 
   H 163    0.5572     3.1879    13.8394     2.0403    17.9503    18.1561 
   H 164    3.6200     1.8396    16.7392     2.2901    20.9435    21.0416 
   H 165    3.1408     3.1408    17.1443     1.4158    21.2922    21.4639 
   H 166    0.6200     4.0130    14.4862     1.8397    18.5284    18.7860 
   H 167    1.4956     4.0477    15.6573     1.1766    19.7036    19.9591 
   H 168    2.3716     4.6200    16.4761     1.6200    20.4979    20.7702 
   H 169    2.5558     4.0477    16.8019     1.1766    20.8773    21.1124 

              C  25      C  26      C  27      C  28      C  29      C  30
              ------------------------------------------------------------------
   C  25    0.0000 
   C  26    1.0000     0.0000 
   C  27    2.0000     1.7320     0.0000 
   C  28    1.9318     1.0000     2.3941     0.0000 
   C  29    2.3941     2.9093     1.9318     3.8637     0.0000 
   C  30    2.7320     2.9093     1.4142     3.7320     1.0000     0.0000 
   C  31    2.0000     3.0000     3.4641     3.8982     2.5036     3.3859 
   C  32    3.0000     4.0000     4.3589     4.8916     3.0880     4.0576 
   C  33    2.9999     2.6457     1.0000     3.1196     2.3941     1.5059 
   C  34    2.3942     1.7321     3.3461     1.0001     4.6252     4.6252 
   C  35    3.6055     4.5826     5.1961     5.3785     4.0664     5.0195 
   C  36    3.4641     4.3589     5.2915     5.0195     4.5020     5.3785 
   C  37    2.6458     3.4641     4.5826     4.0576     4.1231     4.8916 
   C  38    2.7320     1.7320     2.4495     1.0000     4.2341     3.8637 
   C  39    3.3859     2.6458     4.1144     1.7321     5.5549     5.4641 
   C  40    3.6055     3.0000     1.7321     3.1623     3.3859     2.5036 
   C  41    3.0000     3.6055     5.0000     3.9664     4.8715     5.5372 
   C  42    5.1962     6.0828     7.0000     6.7029     6.0445     6.9757 
   C  43    6.0828     6.9282     7.9372     7.4785     7.0382     7.9619 
   C  44    6.9282     7.8102     8.7177     8.4059     7.6683     8.6251 
   C  45    7.0000     7.9372     8.6602     8.6251     7.4210     8.4059 
   C  46    6.2450     7.2111     7.8102     7.9619     6.4863     7.4785 
   C  47    4.4641     3.4641     3.8730     2.6458     5.7786     5.2338 
   C  48    4.5826     4.0000     2.6458     4.1231     4.0576     3.0880 
   C  49    5.0001     6.0000     6.2450     6.8842     4.6981     5.6978 
   C  50   10.5382     9.5394     9.7843     8.6603    11.7153    11.0113 
   C  51    6.5575     7.5498     7.9372     8.3740     6.4296     7.4294 
   C  52    9.6602     8.6602     8.8318     7.8102    10.7603    10.0391 
   C  53   11.4402    10.4402    10.5982     9.5824    12.5236    11.7835 
   C  54   12.1377    11.1404    11.4020    10.2484    13.3328    12.6238 
   C  55   11.7331    10.7447    11.1510     9.8168    13.0807    12.4270 
   C  56    5.3535     4.3589     4.8716     3.4641     6.7717     6.2335 
   C  57    8.8084     7.8102     8.1075     6.9282    10.0391     9.3693 
   C  58    5.2915     4.5826     3.4641     4.5020     5.0195     4.0664 
   C  59    9.7119     8.7178     8.6912     7.9373    10.5981     9.8143 
   C  60    7.2111     7.9372     9.1651     8.3184     8.5010     9.3731 
   C  61    7.9282     6.9282     7.1414     6.0828     9.0730     8.3857 
   C  62    6.1961     5.1962     5.4773     4.3589     7.4065     6.7717 
   C  63    8.1854     9.1652     9.6437     9.9427     8.1614     9.1613 
   C  64   12.2972    11.3221    11.8428    10.3680    13.7638    13.1522 
   C  65    6.2449     5.5677     4.3589     5.5016     5.7616     4.7753 
   C  66    7.0798     6.0828     6.4600     5.1962     8.3857     7.7666 
   C  67    7.9910     7.0000     6.9668     6.2450     8.8801     8.1152 
   C  68   13.2916    12.3145    12.8091    11.3633    14.7336    14.1066 
   C  69    9.8651     8.8882     9.4302     7.9373    11.3452    10.7570 
   C  70   13.9004    12.9379    13.5269    11.9686    15.4407    14.8507 
   C  71   14.8885    13.9229    14.4844    12.9568    16.4028    15.7975 
   C  72   15.5313    14.5803    15.2217    13.6014    17.1285    16.5561 
   C  73   16.5127    15.5578    16.1717    14.5819    18.0838    17.4964 
   C  74   16.8689    15.8984    16.4145    14.9378    18.3390    17.7086 
   C  75   17.1820    16.2414    16.9241    15.2562    18.8244    18.2666 
   C  76   18.1568    17.2117    17.8675    16.2291    19.7736    19.2013 
   C  77   18.4813    17.5202    18.0876    16.5496    20.0073    19.3948 
   C  78   18.8473    17.9160    18.6320    16.9265    20.5264    19.9808 
   C  79   19.8159    18.8796    19.5696    17.8924    21.4701    20.9105 
   C  80   20.1137    19.1613    19.7708    18.1836    21.6856    21.0884 
   C  81   19.8470    18.8715    19.3364    17.9173    21.2657    20.6070 
   H  82    0.9341     1.9294     2.5045     2.8612     2.1030     2.7617 
   H  83    0.8501     1.8500     2.5343     2.7617     2.2321     2.8612 
   H  84    2.5342     1.9293     0.8500     2.2321     2.7616     2.1029 
   H  85    1.4602     0.9341     2.6602     0.8500     3.7350     3.8276 
   H  86    2.0631     2.7583     2.1763     3.7513     0.6200     1.5679 
   H  87    2.9034     3.4980     2.5357     4.4654     0.6200     1.4158 
   H  88    2.8242     3.1762     1.8699     4.0684     0.6200     0.5573 
   H  89    2.8015     3.1762     1.9037     4.0775     0.5573     0.6200 
   H  90    3.3520     3.4980     1.9037     4.2801     1.4158     0.6200 
   H  91    2.8015     2.7583     1.0697     3.4639     1.5679     0.6200 
   H  92    2.5343     3.5032     3.5669     4.4655     2.1606     3.1408 
   H  93    2.6782     3.6500     3.7111     4.6098     2.2712     3.2580 
   H  94    3.3532     3.1407     1.4158     3.6973     2.2455     1.2563 
   H  95    2.6595     2.1829     3.8703     1.5968     4.9967     5.0908 
   H  96    1.8747     1.4156     3.1348     1.0813     4.1996     4.3112 
   H  97    4.2395     5.1791     5.9475     5.8950     4.9050     5.8473 
   H  98    4.2217     5.1501     5.9601     5.8473     4.9617     5.8950 
   H  99    2.0791     2.7609     4.0771     3.2580     3.9743     4.6098 
   H 100    1.4158     1.8397     3.3533     2.2456     3.6973     4.1394 
   H 101    1.3894     1.4158     3.0890     1.6200     3.7832     4.0684 
   H 102    3.3756     2.5121     3.7920     1.5201     5.3784     5.1820 
   H 103    4.0028     3.2380     4.6353     2.2901     6.1423     6.0090 
   H 104    3.5075     2.9083     4.4996     2.1115     5.7926     5.7990 
   H 105    3.4849     2.7431     1.8397     2.7296     3.6800     2.8890 
   H 106    2.4825     3.0148     4.4738     3.3468     4.5211     5.1116 
   H 107    3.3533     3.8242     5.3371     4.0352     5.3768     5.9865 
   H 108    3.5505     4.2047     5.5456     4.5861     5.2718     5.9967 
   H 109    5.2653     6.0723     7.1709     6.5825     6.4250     7.3079 
   H 110    3.4849     4.4187     4.2029     5.4023     2.4675     3.4558 
   H 111    3.7684     2.8292     3.8580     1.8397     5.5825     5.2711 
   H 112    5.4058     6.2067     7.3159     6.7066     6.5750     7.4575 
   H 113    6.9801     7.8021     8.8556     8.3102     7.9717     8.8959 
   H 114    7.1709     8.1408     8.7018     8.8959     7.3124     8.3102 
   H 115    5.6633     6.6500     7.1185     7.4575     5.7092     6.7066 
   H 116    4.0932     3.1021     3.3133     2.4059     5.2353     4.6501 
   H 117    4.8857     3.8917     4.0621     3.1512     5.9920     5.3609 
   H 118    4.8212     4.3433     2.8292     4.5758     3.9717     2.9743 
   H 119    5.5457     6.5443     6.8485     7.4054     5.3179     6.3176 
   H 120    5.3371     6.3328     6.4222     7.2506     4.7563     5.7459 
   H 121    4.4739     5.4719     5.6451     6.3807     4.0784     5.0780 
   H 122    9.8606     8.8659     9.2163     7.9609    11.1472    10.4860 
   H 123    7.1345     8.1225     8.5469     8.9286     7.0495     8.0493 
   H 124    6.8180     7.8169     8.0774     8.6777     6.4723     7.4664 
   H 125    5.9890     6.9852     7.3293     7.8293     5.8097     6.8095 
   H 126    8.9342     7.9355     8.0312     7.1185     9.9555     9.2175 
   H 127   10.7883     9.7892     9.8641     8.9629    11.7821    11.0199 
   H 128   12.4136    11.4136    11.5508    10.5574    13.4730    12.7199 
   H 129   11.3234    10.3475    10.8746     9.3947    12.7938    12.1900 
   H 130    8.3334     9.2024    10.1333     9.7682     9.0650    10.0284 
   H 131    5.4465     4.4726     5.1850     3.5192     7.0447     6.5763 
   H 132    9.5751     8.5804     8.9346     7.6761    10.8652    10.2079 
   H 133    5.2100     4.4186     3.5191     4.2093     5.2225     4.3144 
   H 134    9.0954     8.1022     8.0736     7.3294     9.9826     9.2047 
   H 135    9.7951     8.8105     8.6610     8.0774    10.5441     9.7241 
   H 136   10.3287     9.3339     9.3091     8.5469    11.2141    10.4251 
   H 137    7.0878     7.7565     9.0684     8.0696     8.5334     9.3695 
   H 138    7.8144     8.5255     9.7747     8.8815     9.1210     9.9928 
   H 139    7.3846     8.1612     9.3022     8.6047     8.5139     9.4178 
   H 140    6.2271     5.2330     5.3139     4.4727     7.2439     6.5463 
   H 141    8.7778     9.7532    10.2566    10.5167     8.7813     9.7812 
   H 142    8.3956     9.3864     9.7593    10.1998     8.1951     9.1913 
   H 143    7.5974     8.5817     9.0317     9.3746     7.5415     8.5414 
   H 144   12.0612    11.0982    11.7034    10.1294    13.6126    13.0373 
   H 145    7.1505     6.1648     6.6996     5.2331     8.6077     8.0444 
   H 146    6.1021     5.5054     4.1517     5.5514     5.3961     4.3984 
   H 147    6.8428     6.1810     4.9340     6.1215     6.2578     5.2626 
   H 148    6.4445     5.6971     4.6402     5.5213     6.1678     5.1990 
   H 149   12.2846    11.2889    11.2565    10.4905    13.1543    12.3489 
   H 150   13.3567    12.3568    12.5006    11.4946    14.4224    13.6664 
   H 151    7.3763     6.3870     6.3506     5.6452     8.2666     7.5107 
   H 152    8.0920     7.1151     6.9292     6.4222     8.8155     8.0058 
   H 153    8.6064     7.6141     7.5836     6.8484     9.4945     8.7219 
   H 154   13.5575    12.5720    12.9901    11.6363    14.9201    14.2616 
   H 155   10.0770     9.0888     9.5223     8.1613    11.4489    10.8169 
   H 156   10.4555     9.4828    10.0462     8.5255    11.9593    11.3756 
   H 157    9.6883     8.7272     9.3783     7.7565    11.2746    10.7327 
   H 158   13.6920    12.7423    13.4050    11.7625    15.3060    14.7490 
   H 159   15.1263    14.1511    14.6447    13.1969    16.5705    15.9360 
   H 160   15.3451    14.4071    15.1135    13.4205    17.0072    16.4650 
   H 161   16.2976    15.3237    15.8186    14.3676    17.7448    17.1072 
   H 162   17.1155    16.1372    16.5936    15.1874    18.5228    17.8671 
   H 163   17.4435    16.4764    17.0120    15.5118    18.9349    18.3112 
   H 164   20.2518    19.3236    20.0474    18.3329    21.9408    21.3966 
   H 165   20.7221    19.7678    20.3647    18.7915    22.2815    21.6776 
   H 166   18.1109    17.1314    17.5723    16.1835    19.5024    18.8379 
   H 167   19.2804    18.3022    18.7475    17.3522    20.6777    20.0123 
   H 168   20.1032    19.1218    19.5363    18.1772    21.4676    20.7881 
   H 169   20.4165    19.4439    19.9271    18.4859    21.8554    21.2032 

              C  31      C  32      C  33      C  34      C  35      C  36
              ------------------------------------------------------------------
   C  31    0.0000 
   C  32    1.0000     0.0000 
   C  33    4.3589     5.1961     0.0000 
   C  34    4.1469     5.0920     4.1144     0.0000 
   C  35    1.7320     1.0000     6.0827     5.4034     0.0000 
   C  36    2.0000     1.7320     6.2449     4.8716     1.0000     0.0000 
   C  37    1.7320     2.0000     5.5677     3.8730     1.7320     1.0000 
   C  38    4.7321     5.7320     2.8754     1.7321     6.2919     5.9880 
   C  39    5.1374     6.0710     4.7603     1.0000     6.3344     5.7383 
   C  40    5.1962     6.0828     1.0001     4.1469     6.9282     7.0000 
   C  41    2.6457     3.0000     6.0000     3.5406     2.6457     1.7320 
   C  42    3.6055     3.0000     7.9372     6.4601     2.0000     1.7321 
   C  43    4.5826     4.0000     8.8881     7.1414     3.0000     2.6458 
   C  44    5.2915     4.5826     9.6436     8.1075     3.6055     3.4641 
   C  45    5.1961     4.3589     9.5393     8.4378     3.4641     3.6055 
   C  46    4.3589     3.4641     8.6602     7.8695     2.6458     3.0000 
   C  47    6.4641     7.4641     3.9416     3.0000     8.0110     7.6624 
   C  48    6.0828     6.9282     1.7321     5.0920     7.8102     7.9372 
   C  49    3.0000     2.0000     7.0000     7.0280     1.7321     2.6458 
   C  50   12.5363    13.5355     9.5432     8.7178    14.0311    13.5823 
   C  51    4.5826     3.6055     8.7177     8.3900     3.0000     3.6056 
   C  52   11.6603    12.6602     8.5639     7.9372    13.1887    12.7782 
   C  53   13.4402    14.4401    10.2978     9.6766    14.9598    14.5325 
   C  54   14.1337    15.1320    11.1510    10.2643    15.6089    15.1354 
   C  55   13.7150    14.7078    10.9857     9.7450    15.1320    14.6089 
   C  56    7.3472     8.3451     4.9263     3.6055     8.8377     8.4207 
   C  57   10.8058    11.8048     7.9249     7.0000    12.2996    11.8584 
   C  58    6.9282     7.8102     2.6458     5.4034     8.6602     8.7177 
   C  59   11.7031    12.6997     8.3153     8.1853    13.2919    12.9517 
   C  60    6.0000     5.5677    10.1488     7.7977     4.5826     4.0000 
   C  61    9.9282    10.9282     6.9334     6.2450    11.4609    11.0646 
   C  62    8.1962     9.1962     5.3670     4.5826     9.7347     9.3578 
   C  63    6.2450     5.2915    10.4403     9.8688     4.5826     5.0001 
   C  64   14.2578    15.2419    11.7375    10.2109    15.6141    15.0417 
   C  65    7.8102     8.6602     3.4641     6.3975     9.5393     9.6436 
   C  66    9.0760    10.0746     6.3668     5.2915    10.5685    10.1373 
   C  67    9.9785    10.9739     6.6239     6.5574    11.5795    11.2645 
   C  68   15.2548    16.2398    12.6797    11.2108    16.6141    16.0407 
   C  69   11.8306    12.8173     9.3666     7.8102    13.2090    12.6631 
   C  70   15.8395    16.8144    13.4482    11.7464    17.1419    16.5268 
   C  71   16.8320    17.8084    14.3827    12.7436    18.1404    17.5267 
   C  72   17.4498    18.4155    15.1638    13.3302    18.7053    18.0559 
   C  73   18.4370    19.4048    16.0919    14.3219    19.7008    19.0544 
   C  74   18.8192    19.7981    16.2749    14.7391    20.1377    19.5266 
   C  75   19.0814    20.0384    16.8828    14.9469    20.2962    19.6188 
   C  76   20.0631    21.0227    17.8055    15.9322    21.2877    20.6143 
   C  77   20.4149    21.3862    17.9711    16.3082    21.6927    21.0516 
   C  78   20.7294    21.6783    18.6042    16.5870    21.9085    21.2080 
   C  79   21.7056    22.6575    19.5223    17.5656    22.8956    22.1997 
   C  80   22.0312    22.9952    19.6735    17.9074    23.2727    22.6064 
   C  81   21.8046    22.7861    19.1545    17.7343    23.1346    22.5265 
   H  82    1.0828     2.0790     3.4601     3.2322     2.7608     2.7878 
   H  83    1.1500     2.1500     3.5032     3.1028     2.7878     2.7608 
   H  84    4.2216     5.1500     0.9341     3.2321     5.9474     5.9600 
   H  85    3.2637     4.2322     3.5424     0.9341     4.6302     4.2080 
   H  86    1.8848     2.4901     2.8242     4.4117     3.4584     3.8823 
   H  87    2.6112     3.0021     2.9034     5.1985     4.0015     4.5627 
   H  88    3.1229     3.6932     2.0631     4.9082     4.6776     5.1217 
   H  89    3.0608     3.6234     2.1241     4.9082     4.6087     5.0589 
   H  90    3.9034     4.4985     1.6788     5.1985     5.4810     5.9032 
   H  91    3.7853     4.5352     0.8901     4.4117     5.4699     5.7473 
   H  92    0.8500     0.9341     4.3442     4.8388     1.9293     2.5342 
   H  93    0.9341     0.8500     4.4802     4.9723     1.8500     2.5045 
   H  94    4.4726     5.2330     0.6200     4.6841     6.1647     6.4221 
   H  95    4.2058     5.0987     4.6832     0.6200     5.2956     4.6671 
   H  96    3.5407     4.4774     3.9979     0.6201     4.7844     4.2689 
   H  97    2.5045     1.8500     6.8609     5.7920     0.8501     0.9341 
   H  98    2.5343     1.9294     6.8828     5.7208     0.9341     0.8501 
   H  99    1.9294     2.5343     5.0766     3.0250     2.5045     1.8500 
   H 100    2.2901     3.1407     4.3433     2.0584     3.3532     2.8291 
   H 101    2.7898     3.7025     4.0432     1.4158     3.9878     3.4887 
   H 102    5.2500     6.2167     4.3441     1.1766     6.5692     6.0480 
   H 103    5.7531     6.6810     5.2171     1.6199     6.9213     6.2955 
   H 104    5.0981     5.9862     5.2171     1.1766     6.1533     5.4815 
   H 105    5.2331     6.1648     1.4158     3.6842     6.9559     6.9386 
   H 106    2.5121     3.0634     5.4718     2.9368     2.9083     2.1114 
   H 107    3.2380     3.6200     6.3328     3.4659     3.2380     2.2901 
   H 108    2.9083     3.0634     6.5442     4.1492     2.5121     1.5200 
   H 109    3.9271     3.5032     8.1408     6.2178     2.5343     1.9294 
   H 110    1.8397     1.4158     4.8399     5.8302     2.2900     3.1407 
   H 111    5.7090     6.6925     4.2692     1.7732     7.1026     6.6264 
   H 112    4.0771     3.6500     8.2869     6.3286     2.6782     2.0791 
   H 113    5.5156     4.9267     9.8118     7.9158     3.9271     3.5669 
   H 114    5.2652     4.3442     9.5326     8.7985     3.5669     3.9271 
   H 115    3.7111     2.7609     7.9355     7.4581     2.0791     2.6782 
   H 116    6.0841     7.0815     3.3302     2.9561     7.6834     7.4022 
   H 117    6.8791     7.8770     3.9768     3.5889     8.4694     8.1665 
   H 118    6.1648     6.9559     1.8397     5.5624     7.8743     8.0774 
   H 119    3.5505     2.5559     7.6142     7.4981     2.1115     2.9083 
   H 120    3.3533     2.3716     7.1151     7.4596     2.2901     3.2380 
   H 121    2.4825     1.4956     6.3870     6.5829     1.5201     2.5121 
   H 122   11.8527    12.8496     9.0441     7.9655    13.3138    12.8365 
   H 123    5.1724     4.2047     9.3339     8.9089     3.5505     4.0751 
   H 124    4.8212     3.8242     8.8104     8.7547     3.3533     4.0601 
   H 125    4.0019     3.0148     8.1021     7.8858     2.4825     3.1879 
   H 126   10.9324    11.9317     7.7357     7.3159    12.4910    12.1176 
   H 127   12.7869    13.7863     9.5266     9.1223    14.3390    13.9496 
   H 128   14.4136    15.4136    11.2286    10.6477    15.9348    15.5058 
   H 129   13.2859    14.2711    10.7832     9.2484    14.6508    14.0882 
   H 130    6.7055     5.9770    11.0591     9.4212     5.0105     4.8708 
   H 131    7.4152     8.4051     5.3380     3.4849     8.8337     8.3526 
   H 132   11.5674    12.5645     8.7693     7.6859    13.0305    12.5563 
   H 133    6.9559     7.8743     2.8292     5.0570     8.6824     8.6685 
   H 134   11.0855    12.0817     7.7078     7.5974    12.6783    12.3463 
   H 135   11.7723    12.7635     8.2187     8.3955    13.3930    13.0965 
   H 136   12.3209    13.3178     8.9245     8.7777    13.9060    13.5583 
   H 137    6.0319     5.6972    10.0616     7.4904     4.7391     4.0478 
   H 138    6.6200     6.1810    10.7603     8.3316     5.1928     4.6201 
   H 139    6.0319     5.5055    10.2728     8.1406     4.5067     4.0478 
   H 140    8.2196     9.2171     5.0958     4.8212     9.8094     9.4922 
   H 141    6.8485     5.9015    11.0576    10.4171     5.1725     5.5457 
   H 142    6.4222     5.4429    10.5178    10.1807     4.8213     5.3371 
   H 143    5.6451     4.6842     9.8233     9.3295     4.0019     4.4739 
   H 144   14.0028    14.9793    11.6499     9.9181    15.3177    14.7167 
   H 145    9.1312    10.1244     6.6905     5.2100    10.5652    10.0808 
   H 146    7.5557     8.3674     3.1995     6.4883     9.2743     9.4386 
   H 147    8.3705     9.2024     4.0131     7.0148    10.0957    10.2247 
   H 148    8.1043     8.9863     3.8121     6.3660     9.8363     9.8832 
   H 149   14.2781    15.2754    10.8447    10.6866    15.8568    15.4941 
   H 150   15.3566    16.3565    12.1736    11.5669    16.8702    16.4305 
   H 151    9.3618    10.3566     6.0241     5.9890    10.9681    10.6641 
   H 152   10.0595    11.0476     6.5023     6.8179    11.6955    11.4307 
   H 153   10.5955    11.5914     7.2271     7.1345    12.1918    11.8669 
   H 154   15.5340    16.5243    12.8145    11.5310    16.9288    16.3819 
   H 155   12.0593    13.0525     9.3935     8.1043    13.4834    12.9730 
   H 156   12.4140    13.3978     9.9865     8.3704    13.7731    13.2098 
   H 157   11.6304    12.6082     9.3806     7.5557    12.9585    12.3765 
   H 158   15.6103    16.5767    13.3718    11.4928    16.8723    16.2315 
   H 159   17.0854    18.0683    14.5017    13.0262    18.4291    17.8395 
   H 160   17.2421    18.1988    15.0961    13.1073    18.4587    17.7860 
   H 161   18.2540    19.2356    15.6696    14.1866    19.5882    18.9893 
   H 162   19.0788    20.0631    16.4180    15.0255    20.4285    19.8391 
   H 163   19.3877    20.3639    16.8812    15.2967    20.6911    20.0686 
   H 164   22.1271    23.0725    20.0194    17.9827    23.2908    22.5798 
   H 165   22.6425    23.6077    20.2578    18.5209    23.8886    23.2243 
   H 166   20.0759    21.0609    17.3832    16.0251    21.4282    20.8389 
   H 167   21.2430    22.2268    18.5563    17.1844    22.5868    21.9893 
   H 168   22.0711    23.0571    19.3244    18.0247    23.4279    22.8387 
   H 169   22.3692    23.3484    19.7539    18.2887    23.6859    23.0678 

              C  37      C  38      C  39      C  40      C  41      C  42
              ------------------------------------------------------------------
   C  37    0.0000 
   C  38    5.0391     0.0000 
   C  39    4.7396     2.0000     0.0000 
   C  40    6.2450     2.6084     4.6040     0.0000 
   C  41    1.0000     4.9659     4.2741     6.5575     0.0000 
   C  42    2.6458     7.6846     7.2568     8.7178     3.0000     0.0000 
   C  43    3.4641     8.4726     7.8695     9.6437     3.6055     1.0000 
   C  44    4.3589     9.3940     8.8539    10.4403     4.5826     1.7320 
   C  45    4.5826     9.5906     9.2514    10.3923     5.0000     2.0000 
   C  46    4.0000     8.9022     8.7362     9.5394     4.5826     1.7320 
   C  47    6.6921     1.7321     2.6457     3.2570     6.5054     9.3330 
   C  48    7.2111     3.4744     5.4707     1.0000     7.5498     9.6437 
   C  49    3.4641     7.7321     7.9866     7.9373     4.3589     2.6457 
   C  50   12.5867     7.8103     7.9373     8.6035    12.2079    15.1721 
   C  51    4.5826     9.2726     9.3014     9.6437     5.2915     2.6457 
   C  52   11.7882     6.9282     7.2111     7.6170    11.4587    14.3966 
   C  53   13.5394     8.7083     8.9141     9.3361    13.1800    16.1354 
   C  54   14.1373     9.4141     9.4488    10.2042    13.7225    16.7021 
   C  55   13.6090     9.0387     8.8819    10.0731    13.1395    16.1338 
   C  56    7.4330     2.6458     3.0000     4.1962     7.1451    10.0516 
   C  57   10.8643     6.0828     6.2450     7.0153    10.5058    13.4588 
   C  58    7.9372     3.6888     5.6093     1.7320     8.1853    10.4403 
   C  59   11.9760     7.0000     7.5498     7.3364    11.7259    14.6103 
   C  60    4.5826     9.3158     8.3666    10.8166     4.3589     2.6457 
   C  61   10.0782     5.1962     5.5678     6.0179     9.7796    12.6969 
   C  62    8.3772     3.4641     4.0000     4.5179     8.1229    11.0072 
   C  63    6.0000    10.8710    10.7354    11.3579     6.5575     3.6056 
   C  64   14.0436     9.6452     9.3041    10.8506    13.5157    16.5158 
   C  65    8.8881     4.6771     6.5724     2.6457     9.1651    11.3578 
   C  66    9.1455     4.3589     4.5826     5.5147     8.8155    11.7510 
   C  67   10.2973     5.2915     6.0000     5.6586    10.0914    12.9386 
   C  68   15.0428    10.6322    10.3034    11.7793    14.5108    17.5107 
   C  69   11.6633     7.2111     6.9282     8.5095    11.1763    14.1729 
   C  70   15.5339    11.2861    10.8092    12.5706    14.9529    17.9469 
   C  71   16.5337    12.2633    11.8081    13.4921    15.9523    18.9459 
   C  72   17.0698    12.9506    12.3737    14.2935    16.4470    19.4271 
   C  73   18.0677    13.9188    13.3680    15.2093    17.4468    20.4272 
   C  74   18.5334    14.2271    13.8065    15.3646    17.9513    20.9440 
   C  75   18.6402    14.6309    13.9778    16.0184    17.9838    20.9460 
   C  76   19.6347    15.5909    14.9658    16.9295    18.9817    21.9452 
   C  77   20.0640    15.8668    15.3587    17.0691    19.4464    22.4271 
   C  78   20.2370    16.3220    15.6093    17.7446    19.5533    22.4957 
   C  79   21.2273    17.2748    16.5905    18.6518    20.5480    23.4928 
   C  80   21.6251    17.5242    16.9459    18.7787    20.9780    23.9436 
   C  81   21.5332    17.1887    16.8049    18.2242    20.9502    23.9420 
   H  82    2.1500     3.6594     4.2321     4.2217     2.7879     4.4969 
   H  83    2.0790     3.5821     4.1026     4.2395     2.6781     4.4802 
   H  84    5.1790     1.9437     3.8349     1.0829     5.4747     7.6858 
   H  85    3.2323     1.8500     1.9294     3.7801     3.1170     5.8733 
   H  86    3.5248     4.2598     5.3784     3.7853     4.3054     5.4296 
   H  87    4.3156     4.8538     6.1423     3.9034     5.1410     6.0010 
   H  88    4.7269     4.2987     5.7926     3.0608     5.4494     6.6603 
   H  89    4.6725     4.3243     5.7990     3.1229     5.4023     6.5928 
   H  90    5.4633     4.3243     6.0090     2.6112     6.1362     7.4602 
   H  91    5.1761     3.4532     5.1820     1.8848     5.7362     7.3908 
   H  92    2.5045     5.2093     5.8380     5.2653     3.4601     3.9271 
   H  93    2.5343     5.3579     5.9709     5.4058     3.5032     3.8500 
   H  94    5.8193     3.4937     5.3616     1.4158     6.3328     8.0774 
   H  95    3.6707     2.3452     1.0813     4.7566     3.1958     6.1755 
   H  96    3.2731     2.0296     1.5968     4.1800     3.0076     5.8804 
   H  97    1.9294     6.8472     6.6690     7.6762     2.6216     1.1500 
   H  98    1.8500     6.8062     6.5876     7.6859     2.5045     1.0828 
   H  99    0.8500     4.2509     3.8913     5.6633     0.9341     3.4601 
   H 100    1.8396     3.2414     2.9825     4.8213     1.7732     4.4726 
   H 101    2.4990     2.6200     2.3716     4.4071     2.3479     5.1275 
   H 102    5.0492     1.4956     0.6200     4.0972     4.6817     7.6270 
   H 103    5.3006     2.3716     0.6200     4.9679     4.7777     7.7743 
   H 104    4.4947     2.5558     0.6200     5.1356     3.9226     6.9224 
   H 105    6.1257     2.0626     4.0619     0.6200     6.3470     8.6686 
   H 106    1.1766     4.3462     3.7063     5.9890     0.6200     3.5505 
   H 107    1.6200     5.0210     4.0830     6.8180     0.6200     3.3533 
   H 108    1.1766     5.5857     4.8547     7.1345     0.6200     2.4825 
   H 109    2.6216     7.5798     6.9366     8.8557     2.6782     0.8500 
   H 110    3.3533     6.0860     6.8302     5.8142     4.3433     4.2100 
   H 111    5.6314     1.4158     1.2347     3.8769     5.3080     8.2319 
   H 112    2.7609     7.7047     7.0361     8.9985     2.7879     0.9341 
   H 113    4.3442     9.3085     8.5935    10.5557     4.3786     1.9293 
   H 114    4.9267     9.8349     9.6580    10.4270     5.4747     2.5342 
   H 115    3.6500     8.3665     8.3675     8.8387     4.3787     1.9294 
   H 116    6.4546     1.4155     2.8113     2.6380     6.3576     9.1001 
   H 117    7.2088     2.1829     3.2657     3.1764     7.0659     9.8541 
   H 118    7.4070     4.0012     6.0012     1.4158     7.8169     9.7593 
   H 119    3.8121     8.2748     8.4400     8.5470     4.6403     2.5121 
   H 120    4.0131     8.0600     8.4328     8.0775     4.9340     3.2380 
   H 121    3.1995     7.2018     7.5569     7.3294     4.1517     2.9083 
   H 122   11.8385     7.1466     7.1569     8.1344    11.4310    14.4066 
   H 123    5.0675     9.8395     9.8037    10.2566     5.7166     2.9083 
   H 124    5.0104     9.5477     9.6873     9.7593     5.7745     3.2380 
   H 125    4.1339     8.7129     8.8142     9.0317     4.9080     2.5121 
   H 126   11.1351     6.2067     6.6500     6.7817    10.8536    13.7603 
   H 127   12.9628     8.0593     8.4095     8.5555    12.6499    15.5787 
   H 128   14.5122     9.6816     9.8773    10.2593    14.1462    17.1055 
   H 129   13.0893     8.6703     8.3499     9.9059    12.5763    15.5759 
   H 130    5.7415    10.7616    10.1239    11.8552     5.8809     3.1408 
   H 131    7.3556     2.8292     2.7431     4.6726     6.9882     9.9406 
   H 132   11.5586     6.8610     6.8828     7.8637    11.1565    14.1298 
   H 133    7.8437     3.3254     5.1737     1.8396     8.0177    10.3992 
   H 134   11.3733     6.3870     6.9853     6.7327    11.1375    14.0102 
   H 135   12.1325     7.1151     7.8169     7.2267    11.9308    14.7752 
   H 136   12.5805     7.6141     8.1225     7.9426    12.3175    15.2119 
   H 137    4.5067     9.0602     8.0039    10.6847     4.1517     2.9083 
   H 138    5.1928     9.8764     8.8663    11.4195     4.9340     3.2380 
   H 139    4.7390     9.6047     8.7582    10.9821     4.6402     2.5121 
   H 140    8.5270     3.5192     4.3433     4.1922     8.3419    11.1698 
   H 141    6.5443    11.4525    11.2691    11.9727     7.0589     4.0751 
   H 142    6.3328    11.1066    11.0714    11.4563     6.9530     4.0601 
   H 143    5.4719    10.2938    10.2115    10.7436     6.0780     3.1879 
   H 144   13.7215     9.4485     8.9890    10.7896    13.1616    16.1597 
   H 145    9.0828     4.4727     4.4187     5.8854     8.6888    11.6563 
   H 146    8.7271     4.8006     6.7532     2.5120     9.0684    11.1362 
   H 147    9.4829     5.2921     7.1746     3.2380     9.7747    11.9334 
   H 148    9.0887     4.6339     6.4462     2.9082     9.3022    11.6083 
   H 149   14.5118     9.5661     9.9908     9.8556    14.2204    17.1360 
   H 150   15.4354    10.6250    10.7809    11.2019    15.0536    18.0207 
   H 151    9.7009     4.6842     5.4719     5.0668     9.5148    12.3443 
   H 152   10.4788     5.4428     6.3328     5.5156    10.3288    13.1245 
   H 153   10.8962     5.9015     6.5442     6.2557    10.6729    13.5352 
   H 154   15.3824    10.8715    10.6449    11.8938    14.8795    17.8787 
   H 155   11.9733     7.3846     7.2581     8.5028    11.5262    14.5147 
   H 156   12.2109     7.8144     7.4716     9.1288    11.7007    14.7000 
   H 157   11.3788     7.0878     6.6400     8.5612    10.8505    13.8505 
   H 158   15.2432    11.1183    10.5391    12.5179    14.6335    17.6198 
   H 159   16.8433    12.4713    12.1072    13.5921    16.2885    19.2865 
   H 160   16.8058    12.8047    12.1386    14.2472    16.1572    19.1253 
   H 161   17.9944    13.6457    13.2617    14.7559    17.4267    20.4227 
   H 162   18.8431    14.4499    14.1072    15.4926    18.2846    21.2819 
   H 163   19.0774    14.8116    14.3574    15.9740    18.4818    21.4706 
   H 164   21.6128    17.7344    17.0021    19.1583    20.9165    23.8475 
   H 165   22.2425    18.1266    17.5607    19.3581    21.5971    24.5633 
   H 166   19.8429    15.4411    15.1071    16.4516    19.2830    22.2798 
   H 167   20.9944    16.6139    16.2615    17.6230    20.4238    23.4186 
   H 168   21.8428    17.4269    17.1072    18.3829    21.2803    24.2764 
   H 169   22.0761    17.7664    17.3534    18.8267    21.4816    24.4698 

              C  43      C  44      C  45      C  46      C  47      C  48
              ------------------------------------------------------------------
   C  43    0.0000 
   C  44    1.0000     0.0000 
   C  45    1.7320     1.0000     0.0000 
   C  46    2.0000     1.7320     1.0000     0.0000 
   C  47   10.0782    11.0226    11.2677    10.6065     0.0000 
   C  48   10.5830    11.3578    11.2694    10.3923     3.7608     0.0000 
   C  49    3.4641     3.6055     2.9999     2.0000     9.4642     8.7178 
   C  50   15.8067    16.7900    17.1551    16.5722     6.0828     8.5064 
   C  51    3.0000     2.6457     1.7320     1.0000    10.9983    10.4403 
   C  52   15.0640    16.0388    16.3677    15.7557     5.1961     7.5072 
   C  53   16.7818    17.7626    18.1138    17.5166     6.9763     9.1589 
   C  54   17.3095    18.2985    18.6921    18.1310     7.6904    10.0731 
   C  55   16.7021    17.6968    18.1310    17.6090     7.3448    10.0403 
   C  56   10.7470    11.7114    12.0147    11.3969     1.0000     4.5982 
   C  57   14.1091    15.0882    15.4374    14.8454     4.3589     7.0205 
   C  58   11.3578    12.1655    12.1243    11.2694     3.4951     1.0000 
   C  59   15.3249    16.2841    16.5559    15.8968     5.2915     7.1015 
   C  60    1.7320     2.0000     3.0000     3.6055    10.7967    11.7898 
   C  61   13.3843    14.3525    14.6602    14.0355     3.4641     6.0239 
   C  62   11.7198    12.6785    12.9592    12.3185     1.7320     4.7133 
   C  63    3.4641     2.6458     1.7321     2.0000    12.5839    12.1656 
   C  64   17.0369    18.0357    18.5157    18.0374     7.9919    10.8743 
   C  65   12.2882    13.0766    12.9999    12.1243     4.3303     1.7320 
   C  66   12.4210    13.3942    13.7235    13.1202     2.6457     5.6759 
   C  67   13.6772    14.6261    14.8701    14.1936     3.6055     5.5099 
   C  68   18.0256    19.0248    19.5106    19.0359     8.9687    11.7667 
   C  69   14.7332    15.7285    16.1713    15.6626     5.5677     8.6149 
   C  70   18.4178    19.4177    19.9439    19.5099     9.6623    12.6055 
   C  71   19.4135    20.4133    20.9426    20.5099    10.6267    13.4945 
   C  72   19.8538    20.8520    21.4169    21.0220    11.3512    14.3368 
   C  73   20.8529    21.8510    22.4169    22.0215    12.3052    15.2233 
   C  74   21.4060    22.4057    22.9402    22.5098    12.5722    15.3136 
   C  75   21.3338    22.3287    22.9262    22.5657    13.0514    16.0683 
   C  76   22.3339    23.3287    23.9258    23.5634    13.9967    16.9527 
   C  77   22.8511    23.8491    24.4168    24.0204    14.2320    17.0339 
   C  78   22.8493    23.8397    24.4650    24.1351    14.7590    17.7999 
   C  79   23.8487    24.8393    25.4631    25.1301    15.6970    18.6826 
   C  80   24.3338    25.3286    25.9250    25.5591    15.9072    18.7563 
   C  81   24.3971    25.3966    25.9375    25.5098    15.5166    18.1141 
   H  82    5.4334     6.2186     6.2066     5.4057     5.3907     5.1501 
   H  83    5.4057     6.2066     6.2186     5.4334     5.3142     5.1791 
   H  84    8.5978     9.4139     9.4059     8.5803     3.1359     2.0791 
   H  85    6.6350     7.5685     7.8112     7.1754     3.4601     4.7709 
   H  86    6.4219     7.0632     6.8393     5.9175     5.8893     4.5352 
   H  87    7.0009     7.5635     7.2388     6.2770     6.3941     4.4985 
   H  88    7.6550     8.2757     8.0084     7.0637     5.7332     3.6234 
   H  89    7.5880     8.2059     7.9363     6.9909     5.7717     3.6932 
   H  90    8.4534     9.0807     8.8121     7.8643     5.5825     3.0021 
   H  91    8.3652     9.0673     8.8940     7.9845     4.7161     2.4901 
   H  92    4.9267     5.5156     5.2652     4.3442     6.9284     6.0723 
   H  93    4.8500     5.4196     5.1500     4.2216     7.0775     6.2067 
   H  94    9.0478     9.7592     9.5918     8.6824     4.5331     1.8397 
   H  95    6.7958     7.7776     8.1702     7.6620     3.4978     5.7077 
   H  96    6.5895     7.5454     7.8485     7.2633     3.4978     5.1603 
   H  97    2.1500     2.7878     2.7608     2.0790     8.5408     8.5804 
   H  98    2.0790     2.7608     2.7878     2.1500     8.4927     8.5979 
   H  99    4.2216     5.1500     5.4196     4.8500     5.8752     6.6500 
   H 100    5.2330     6.1647     6.4221     5.8193     4.8610     5.8194 
   H 101    5.8724     6.8126     7.0812     6.4768     4.2101     5.4063 
   H 102    8.2872     9.2608     9.6093     9.0460     2.0403     4.9274 
   H 103    8.3491     9.3405     9.7732     9.2870     2.6008     5.7804 
   H 104    7.4798     8.4729     8.9223     8.4605     3.2566     6.0288 
   H 105    9.5669    10.3992    10.4108     9.5919     2.6428     1.4158 
   H 106    4.2047     5.1724     5.5456     5.0675     5.8898     6.9852 
   H 107    3.8242     4.8212     5.3371     5.0104     6.4651     7.8169 
   H 108    3.0148     4.0019     4.4738     4.1339     7.1218     8.1225 
   H 109    0.9341     1.9293     2.5342     2.5045     9.1670     9.8119 
   H 110    5.1927     5.6199     5.1927     4.2100     7.7817     6.5242 
   H 111    8.9119     9.8802    10.2057     9.6176     1.4158     4.6230 
   H 112    0.8500     1.8500     2.5045     2.5343     9.2846     9.9560 
   H 113    0.9341     0.8500     1.8500     2.5045    10.8823    11.5009 
   H 114    2.5045     1.8500     0.8500     0.9341    11.5403    11.2637 
   H 115    2.5343     2.5045     1.8500     0.8500    10.0884     9.6655 
   H 116    9.8843    10.8088    11.0033    10.3047     0.6200     3.1734 
   H 117   10.6201    11.5547    11.7708    11.0846     0.6200     3.5220 
   H 118   10.7175    11.4562    11.3139    10.4108     4.3768     0.6200 
   H 119    3.1995     3.1879     2.4824     1.4955    10.0059     9.3340 
   H 120    4.0130     4.0600     3.3532     2.3715     9.7889     8.8105 
   H 121    3.8121     4.0750     3.5504     2.5558     8.9326     8.1022 
   H 122   15.0231    16.0100    16.3952    15.8322     5.4353     8.1254 
   H 123    3.0634     2.5121     1.5200     1.1766    11.5610    11.0576 
   H 124    3.6200     3.2380     2.2901     1.6200    11.2789    10.5178 
   H 125    3.0634     2.9083     2.1114     1.1766    10.4420     9.8233 
   H 126   14.4571    15.4225    15.7176    15.0792     4.4802     6.6582 
   H 127   16.2555    17.2278    17.5446    16.9195     6.3306     8.3458 
   H 128   17.7465    18.7287    19.0854    18.4909     7.9495    10.0456 
   H 129   16.1118    17.1095    17.5756    17.0857     7.0196     9.9572 
   H 130    2.2901     1.4158     1.8397     2.8292    12.3670    12.7736 
   H 131   10.5927    11.5700    11.9221    11.3466     1.4157     5.1423 
   H 132   14.7505    15.7365    16.1174    15.5513     5.1500     7.8683 
   H 133   11.2926    12.1303    12.1401    11.3139     2.9313     1.4158 
   H 134   14.7329    15.6888    15.9514    15.2864     4.6842     6.5236 
   H 135   15.5168    16.4648    16.7017    16.0150     5.4428     6.9109 
   H 136   15.9190    16.8811    17.1616    16.5079     5.9014     7.6859 
   H 137    2.1115     2.5559     3.5506     4.0751    10.4886    11.6689 
   H 138    2.2901     2.3716     3.3533     4.0601    11.3315    12.3954 
   H 139    1.5200     1.4956     2.4825     3.1879    11.1308    11.9418 
   H 140   11.9178    12.8618    13.0976    12.4209     1.8397     4.2784 
   H 141    3.8121     2.9083     2.1115     2.5559    13.1605    12.7836 
   H 142    4.0131     3.2380     2.2901     2.3716    12.8299    12.2321 
   H 143    3.1995     2.5121     1.5201     1.4956    12.0117    11.5478 
   H 144   16.6549    17.6547    18.1587    17.7056     7.8342    10.8703 
   H 145   12.2879    13.2708    13.6425    13.0765     2.8292     6.1250 
   H 146   12.0836    12.8429    12.7226    11.8265     4.6671     1.5200 
   H 147   12.8703    13.6479    13.5515    12.6651     4.8794     2.2901 
   H 148   12.5201    13.3351    13.3004    12.4459     4.0607     2.1114 
   H 149   17.8254    18.7941    19.0943    18.4524     7.8475     9.5410 
   H 150   18.6497    19.6347    20.0041    19.4190     8.8931    10.9734 
   H 151   13.0928    14.0370    14.2693    13.5858     3.0148     4.9631 
   H 152   13.8920    14.8271    15.0321    14.3259     3.8242     5.2620 
   H 153   14.2647    15.2176    15.4723    14.8025     4.2047     6.0708 
   H 154   18.4168    19.4146    19.8783    19.3808     9.1827    11.8292 
   H 155   15.1034    16.0951    16.5093    15.9725     5.6972     8.5359 
   H 156   15.2409    16.2382    16.6996    16.2075     6.1809     9.2271 
   H 157   14.3802    15.3782    15.8504    15.3714     5.5055     8.7372 
   H 158   18.0650    19.0643    19.6129    19.2035     9.5322    12.6019 
   H 159   19.7772    20.7771    21.2855    20.8304    10.8079    13.5491 
   H 160   19.5270    20.5234    21.1090    20.7380    11.2407    14.3338 
   H 161   20.8992    21.8992    22.4205    21.9770    11.9830    14.6985 
   H 162   21.7650    22.7649    23.2804    22.8294    12.7744    15.4021 
   H 163   21.9185    22.9178    23.4648    23.0470    13.1642    15.9291 
   H 164   24.1832    25.1706    25.8103    25.4961    16.1744    19.2073 
   H 165   24.9539    25.9487    26.5449    26.1780    16.5039    19.3234 
   H 166   22.7596    23.7596    24.2781    23.8289    13.7612    16.3416 
   H 167   23.8864    24.8862    25.4157    24.9765    14.9357    17.5054 
   H 168   24.7503    25.7502    26.2742    25.8282    15.7400    18.2400 
   H 169   24.9127    25.9117    26.4634    26.0469    16.1003    18.7235 

              C  49      C  50      C  51      C  52      C  53      C  54
              ------------------------------------------------------------------
   C  49    0.0000 
   C  50   15.5344     0.0000 
   C  51    1.7320    17.0302     0.0000 
   C  52   14.6603     1.0001    16.1834     0.0000 
   C  53   16.4401     1.0000    17.9564     1.7820     0.0000 
   C  54   17.1294     1.6180    18.6089     2.5876     1.0000     0.0000 
   C  55   16.6960     1.6180    18.1282     2.5876     1.6180     1.0000 
   C  56   10.3423     5.1962    11.8358     4.3589     6.1232     6.7871 
   C  57   13.8033     1.7321    15.2986     1.0000     2.6767     3.3317 
   C  58    9.6437     7.6359    11.3578     6.6361     8.2466     9.1787 
   C  59   14.6944     1.7321    16.2676     1.0000     2.0886     3.0608 
   C  60    5.1961    16.2209     4.5826    15.5538    17.2135    17.6556 
   C  61   12.9282     2.6458    14.4542     1.7320     3.5129     4.2636 
   C  62   11.1962     4.3589    12.7257     3.4641     5.2445     5.9716 
   C  63    3.4641    18.5673     1.7321    17.7450    19.5088    20.1289 
   C  64   17.2157     2.5876    18.5982     3.5202     2.5876     1.7820 
   C  65   10.4403     7.7232    12.1655     6.7363     8.2297     9.1972 
   C  66   12.0726     3.4641    13.5671     2.6457     4.3965     5.0579 
   C  67   12.9669     3.0000    14.5484     2.0000     3.6778     4.5662 
   C  68   18.2146     3.3318    19.5982     4.3156     3.0609     2.0887 
   C  69   14.7961     1.7320    16.2000     2.0000     2.6081     2.7111 
   C  70   18.7722     4.2636    20.1084     5.2268     4.0554     3.0884 
   C  71   19.7683     5.0580    21.1079     6.0458     4.7031     3.7047 
   C  72   20.3569     5.9716    21.6518     6.9460     5.6742     4.6798 
   C  73   21.3495     6.7872    22.6494     7.7769     6.3930     5.3933 
   C  74   21.7616     6.8112    23.1069     7.8112     6.2821     5.3007 
   C  75   21.9640     7.6904    23.2218     8.6704     7.3449     6.3453 
   C  76   22.9524     8.5175    24.2168     9.5083     8.1007     7.1028 
   C  77   23.3362     8.5366    24.6451     9.5364     8.0134     7.0328 
   C  78   23.5888     9.4141    24.8135    10.3973     9.0387     8.0390 
   C  79   24.5728    10.2484    25.8051    11.2399     9.8169     8.8211 
   C  80   24.9318    10.2643    26.2076    11.2637     9.7450     8.7648 
   C  81   24.7537     9.6233    26.1058    10.6166     8.9713     8.0410 
   H  82    4.0771    11.4687     5.6632    10.5861    12.3669    13.0697 
   H  83    4.1500    11.3873     5.7159    10.5103    12.2902    12.9859 
   H  84    7.0656     8.9589     8.7448     8.0000     9.7620    10.5756 
   H  85    6.1993     9.4060     7.6301     8.5804    10.3434    10.9794 
   H  86    4.1829    11.9064     5.9080    10.9680    12.7419    13.5239 
   H  87    4.4047    12.3110     6.1315    11.3514    13.1103    13.9278 
   H  88    5.2361    11.5544     6.9673    10.5849    12.3326    13.1681 
   H  89    5.1623    11.6054     6.8935    10.6370    12.3863    13.2196 
   H  90    6.0197    11.2090     7.7487    10.2252    11.9473    12.8128 
   H  91    6.2489    10.4202     7.9775     9.4440    11.1826    12.0303 
   H  92    2.6782    13.0102     4.3786    12.1077    13.8896    14.6188 
   H  93    2.5343    13.1595     4.2394    12.2574    14.0394    14.7679 
   H  94    6.9386    10.0190     8.6685     9.0318    10.7462    11.6188 
   H  95    6.9723     9.0124     8.2442     8.2728     9.9860    10.5290 
   H  96    6.4085     9.3138     7.7732     8.5194    10.2669    10.8678 
   H  97    1.9294    14.4933     2.6781    13.6794    15.4388    16.0522 
   H  98    2.0791    14.4290     2.7879    13.6209    15.3774    15.9841 
   H  99    4.2217    11.7411     5.4196    10.9481    12.6960    13.2891 
   H 100    5.0104    10.7543     6.3328     9.9497    11.7034    12.3120 
   H 101    5.6180    10.0958     6.9772     9.2900    11.0440    11.6555 
   H 102    8.1741     7.5460     9.5607     6.7780     8.5088     9.0885 
   H 103    8.5856     7.4796     9.8751     6.7959     8.4662     8.9619 
   H 104    7.8437     8.3563     9.0772     7.6699     9.3430     9.8350 
   H 105    8.0775     8.1302     9.7593     7.1536     8.8947     9.7399 
   H 106    4.6403    11.6277     5.7166    10.8669    12.5956    13.1523 
   H 107    4.9340    12.0089     5.7745    11.2941    12.9909    13.4961 
   H 108    4.1517    12.7919     4.9080    12.0533    13.7676    14.2967 
   H 109    3.4601    14.8738     3.4601    14.1342    15.8497    16.3756 
   H 110    2.2901    13.8477     4.0130    12.9266    14.7062    15.4620 
   H 111    8.6708     6.9559    10.1013     6.1648     7.9087     8.5156 
   H 112    3.5669    14.9726     3.5032    14.2381    15.9501    16.4699 
   H 113    4.2394    16.5210     3.4601    15.8036    17.5034    18.0010 
   H 114    2.6781    17.5043     1.0828    16.6894    18.4498    19.0615 
   H 115    1.1500    16.1090     0.9341    15.2678    17.0388    17.6846 
   H 116    9.0780     6.5339    10.6503     5.6148     7.3961     8.1495 
   H 117    9.8741     5.7470    11.4415     4.8211     6.6017     7.3640 
   H 118    8.6686     9.0370    10.3992     8.0369     9.6604    10.5885 
   H 119    0.6200    16.0644     1.1120    15.2004    16.9782    17.6537 
   H 120    0.6200    15.8703     1.8396    14.9799    16.7617    17.4730 
   H 121    0.6200    15.0113     2.3520    14.1267    15.9080    16.6116 
   H 122   14.8448     0.8500    16.3138     0.9751     1.8443     2.2989 
   H 123    2.3520    17.5762     0.6200    16.7385    18.5084    19.1489 
   H 124    1.8396    17.3371     0.6200    16.4735    18.2513    18.9257 
   H 125    1.1120    16.4895     0.6200    15.6332    17.4090    18.0741 
   H 126   13.9307     1.8500    15.4781     0.8500     2.5685     3.4255 
   H 127   15.7855     0.9750    17.3287     1.2030     0.8500     1.8442 
   H 128   17.4137     1.9418    18.9315     2.7537     0.9750     0.8500 
   H 129   16.2469     1.9419    17.6377     2.7537     2.2990     1.8443 
   H 130    4.8212    18.0572     3.5192    17.3299    19.0373    19.5437 
   H 131   10.3907     5.2330    11.8328     4.4726     6.1954     6.7847 
   H 132   14.5598     1.0828    16.0305     0.9341     2.0827     2.5801 
   H 133    9.7593     7.0985    11.4562     6.0986     7.7432     8.6595 
   H 134   14.0759     2.1115    15.6519     1.1766     2.6369     3.5762 
   H 135   14.7495     2.2901    16.3504     1.6199     2.4702     3.4684 
   H 136   15.3130     1.5201    16.8837     1.1766     1.5937     2.5916 
   H 137    5.5323    15.8032     5.0676    15.1586    16.7988    17.2173 
   H 138    5.7415    16.6786     5.0104    16.0305    17.6738    18.0941 
   H 139    4.9155    16.6513     4.1339    15.9633    17.6403    18.1046 
   H 140   11.2134     4.4726    12.7828     3.5191     5.2919     6.0894 
   H 141    4.0841    19.1255     2.3521    18.3114    20.0716    20.6811 
   H 142    3.5191    18.8492     1.8397    18.0100    19.7806    20.4221 
   H 143    2.8441    18.0130     1.1121    17.1823    18.9496    19.5808 
   H 144   16.9407     2.8491    18.2904     3.6992     3.0317     2.3267 
   H 145   12.1141     3.5191    13.5646     2.8292     4.4964     5.0547 
   H 146   10.0929     8.3365    11.8234     7.3477     8.8491     9.8157 
   H 147   10.9511     7.8410    12.6801     6.8712     8.2801     9.2630 
   H 148   10.8121     7.1109    12.5289     6.1266     7.6103     8.5789 
   H 149   17.2710     2.3266    18.8378     2.7929     1.4158     1.9171 
   H 150   18.3565     2.8491    19.8681     3.6992     1.9173     1.4158 
   H 151   12.3488     3.5505    13.9338     2.5557     4.2738     5.1399 
   H 152   13.0294     3.3533    14.6408     2.3715     3.9072     4.8489 
   H 153   13.5851     2.4825    15.1634     1.4955     3.0914     4.0064 
   H 154   18.5082     3.3268    19.9207     4.3268     2.8744     1.8745 
   H 155   15.0416     1.1121    16.4811     1.4956     2.0090     2.2286 
   H 156   15.3718     1.8396    16.7595     2.3716     2.5412     2.4137 
   H 157   14.5729     2.3520    15.9381     2.5558     3.2152     3.2406 
   H 158   18.5202     4.4271    19.8240     5.3489     4.3521     3.4315 
   H 159   20.0391     5.0547    21.4076     6.0538     4.5840     3.5883 
   H 160   20.1249     6.0895    21.3880     7.0384     5.8900     4.9131 
   H 161   21.2039     6.1944    22.5631     7.1945     5.6624     4.6807 
   H 162   22.0361     6.8993    23.4076     7.8964     6.2927     5.3375 
   H 163   22.3226     7.4285    23.6545     8.4284     6.9018     5.9207 
   H 164   24.9763    10.7992    26.1852    11.7869    10.3905     9.3928 
   H 165   25.5461    10.8237    26.8251    11.8237    10.2805     9.3072 
   H 166   23.0347     7.8501    24.4075     8.8433     7.2035     6.2686 
   H 167   24.1984     9.0202    25.5628    10.0118     8.3583     7.4329 
   H 168   25.0325     9.7813    26.4075    10.7661     9.0817     8.1798 
   H 169   25.3119    10.2283    26.6522    11.2230     9.5851     8.6508 

              C  55      C  56      C  57      C  58      C  59      C  60
              ------------------------------------------------------------------
   C  55    0.0000 
   C  56    6.3929     0.0000 
   C  57    3.0608     3.4641     0.0000 
   C  58    9.1972     4.1813     6.2208     0.0000 
   C  59    3.3317     4.5826     1.7320     6.1734     0.0000 
   C  60   16.9724    11.3475    14.5717    12.4899    15.9159     0.0000 
   C  61    4.0554     2.6457     1.0000     5.2374     2.0000    13.9333 
   C  62    5.6742     1.0000     2.6457     4.1016     3.6055    12.3431 
   C  63   19.6090    13.3870    16.8394    13.0767    17.8704     4.5826 
   C  64    1.0001     7.0125     3.8543    10.0608     4.3155    17.2102 
   C  65    9.3236     4.9009     6.4630     1.0000     6.1415    13.4535 
   C  66    4.7031     1.7320     1.7320     5.0091     3.0000    12.9441 
   C  67    4.5662     3.0000     1.7320     4.6371     1.7320    14.3363 
   C  68    1.7321     7.9947     4.7651    10.9286     5.0065    18.1796 
   C  69    1.9713     4.5826     1.7321     7.8674     3.0000    15.0046 
   C  70    2.6458     8.6729     5.5850    11.7925     5.9656    18.4831 
   C  71    3.4642     9.6416     6.4840    12.6601     6.7104    19.4661 
   C  72    4.3589    10.3568     7.3163    13.5243     7.6519    19.8256 
   C  73    5.1962    11.3139     8.2085    14.3918     8.4257    20.8174 
   C  74    5.2915    11.5948     8.3512    14.4467     8.3612    21.4369 
   C  75    6.0828    12.0544     9.0480    15.2562     9.3550    21.2247 
   C  76    6.9283    13.0019     9.9356    16.1235    10.1468    22.2216 
   C  77    7.0000    13.2470    10.0538    16.1725    10.0932    22.8029 
   C  78    7.8103    13.7606    10.7797    16.9881    11.0670    22.6698 
   C  79    8.6603    14.7001    11.6642    17.8553    11.8710    23.6691 
   C  80    8.7178    14.9174    11.7650    17.8996    11.8253    24.2158 
   C  81    8.1854    14.5486    11.2380    17.2149    11.0560    24.4020 
   H  82   12.6672     6.2868     9.7396     5.9475    10.6210     6.7061 
   H  83   12.5747     6.2004     9.6572     5.9601    10.5578     6.6499 
   H  84   10.3457     4.1345     7.2941     2.7609     7.8445     9.7427 
   H  85   10.5078     4.2217     7.6761     5.2442     8.7449     7.4711 
   H  86   13.2287     6.8665    10.2090     5.4699    10.8585     7.8811 
   H  87   13.6866     7.3884    10.6412     5.4810    11.1701     8.5333 
   H  88   12.9607     6.7330     9.9052     4.6087    10.3683     9.1209 
   H  89   13.0081     6.7713     9.9535     4.6776    10.4251     9.0576 
   H  90   12.6615     6.5763     9.6008     4.0015     9.9424     9.9031 
   H  91   11.8499     5.7124     8.7900     3.4584     9.2047     9.7180 
   H  92   14.2442     7.8531    11.2871     6.9801    12.0882     6.4670 
   H  93   14.3920     8.0012    11.4362     7.1185    12.2381     6.4087 
   H  94   11.4872     5.5095     8.4284     2.8292     8.7352    10.3790 
   H  95    9.9623     4.0024     7.3136     6.0225     8.5793     7.3463 
   H  96   10.3582     4.1713     7.5915     5.5783     8.7387     7.3211 
   H  97   15.5343     9.3206    12.7669     9.4060    13.8323     3.7513 
   H  98   15.4590     9.2625    12.7041     9.4140    13.7838     3.6499 
   H  99   12.7590     6.5962    10.0203     7.3159    11.1502     5.1790 
   H 100   11.8028     5.5935     9.0295     6.4222    10.1392     6.1256 
   H 101   11.1528     4.9340     8.3704     5.9415     9.4829     6.7042 
   H 102    8.5702     2.4825     5.8323     5.0194     7.0617     8.8662 
   H 103    8.3621     2.7431     5.8142     5.8202     7.1975     8.7582 
   H 104    9.2247     3.5505     6.6898     6.2050     8.0561     7.8841 
   H 105    9.5700     3.5931     6.5092     1.8396     6.9319    10.6613 
   H 106   12.5856     6.5423     9.9198     7.5973    11.1205     4.9753 
   H 107   12.8789     7.0325    10.3261     8.3955    11.6115     4.3318 
   H 108   13.6990     7.7506    11.0956     8.7777    12.3328     3.7436 
   H 109   15.7686     9.8229    13.1776    10.5557    14.4029     2.0790 
   H 110   15.1213     8.7301    12.1344     7.4796    12.8566     6.8428 
   H 111    8.0320     1.8397     5.2330     4.6017     6.4222     9.5153 
   H 112   15.8571     9.9327    13.2793    10.6968    14.5138     1.9293 
   H 113   17.3645    11.5158    14.8380    12.2646    16.0983     1.1500 
   H 114   18.5346    12.3306    15.7781    12.1541    16.8303     3.8500 
   H 115   17.1985    10.9164    14.3778    10.5628    15.3655     4.2394 
   H 116    7.8513     1.5968     4.8281     2.9899     5.6193    10.6932 
   H 117    7.0890     1.0813     4.0507     3.1111     4.8263    11.3768 
   H 118   10.5866     5.2182     7.5842     1.4158     7.5889    11.9885 
   H 119   17.2024    10.8688    14.3325    10.2566    15.2536     4.9155 
   H 120   17.0665    10.6906    14.1423     9.7593    14.9775     5.7414 
   H 121   16.1975     9.8267    13.2820     9.0317    14.1402     5.5322 
   H 122    1.9418     4.5072     1.1195     7.3072     1.9690    15.4064 
   H 123   18.6533    12.3855    15.8456    11.9726    16.8384     4.5067 
   H 124   18.4701    12.1413    15.6051    11.4562    16.5238     5.1927 
   H 125   17.6094    11.2933    14.7574    10.7435    15.7006     4.7390 
   H 126    3.4255     3.7111     0.9341     5.7865     0.9341    15.0159 
   H 127    2.2989     5.5299     2.1970     7.4226     1.2506    16.7562 
   H 128    1.8443     7.0982     3.6481     9.1152     2.9442    18.1600 
   H 129    0.8500     6.0385     2.9443     9.1651     3.6481    16.3218 
   H 130   18.9124    13.0260    16.3686    13.5795    17.6065     2.2901 
   H 131    6.3058     0.6200     3.5191     4.7732     4.8212    11.1052 
   H 132    2.2192     4.2217     0.8501     7.0604     1.9294    15.1451 
   H 133    8.6434     3.5758     5.6439     0.6200     5.6868    12.3557 
   H 134    3.7284     4.0019     1.5200     5.6104     0.6200    15.3467 
   H 135    3.8517     4.8212     2.2900     5.9531     0.6200    16.1673 
   H 136    3.0114     5.1724     2.1114     6.7464     0.6200    16.4887 
   H 137   16.5159    10.9985    14.1710    12.3324    15.5498     0.6201 
   H 138   17.3925    11.8574    15.0438    13.0868    16.4148     0.6201 
   H 139   17.4389    11.7188    14.9873    12.6759    16.2972     0.6200 
   H 140    5.8899     1.4158     2.8291     3.5934     3.4849    12.6167 
   H 141   20.1488    13.9526    17.3997    13.6928    18.4498     4.7390 
   H 142   19.9254    13.6579    17.1184    13.1623    18.1039     5.1927 
   H 143   19.0741    12.8264    16.2834    12.4610    17.2938     4.5067 
   H 144    1.4158     6.8417     3.8749    10.0927     4.5737    16.7805 
   H 145    4.5839     1.8397     1.8397     5.5129     3.3533    12.7323 
   H 146    9.9341     5.3188     7.0541     1.1766     6.7608    13.3074 
   H 147    9.4543     5.3922     6.6842     1.6200     6.2031    14.0536 
   H 148    8.7142     4.5296     5.8777     1.1766     5.5223    13.6263 
   H 149    2.8490     7.0849     3.7869     8.5765     2.5783    18.3432 
   H 150    2.3266     8.0325     4.5737    10.0351     3.8749    19.0326 
   H 151    5.0793     2.4825     2.1114     4.1251     2.3520    13.7799 
   H 152    4.9584     3.3533     2.2900     4.3396     1.8396    14.6150 
   H 153    4.0830     3.5505     1.5200     5.1728     1.1121    14.8978 
   H 154    1.8397     8.2261     4.8924    10.9627     4.9151    18.6143 
   H 155    1.6561     4.7390     1.5201     7.7409     2.4825    15.4286 
   H 156    1.5369     5.1927     2.2901     8.4703     3.3533    15.4688 
   H 157    2.4079     4.5067     2.1115     8.0398     3.5505    14.5946 
   H 158    2.8292     8.5354     5.5992    11.8196     6.1548    18.0836 
   H 159    3.5192     9.8343     6.5782    12.6896     6.6425    19.8727 
   H 160    4.4727    10.2420     7.3272    13.5480     7.8004    19.4538 
   H 161    4.6841    11.0093     7.7448    13.8293     7.7412    20.9610 
   H 162    5.4429    11.8082     8.4978    14.5154     8.3812    21.8352 
   H 163    5.9015    12.1837     8.9593    15.0643     8.9812    21.9199 
   H 164    9.2025    15.1759    12.1868    18.3898    12.4358    23.9652 
   H 165    9.2901    15.5156    12.3429    18.4595    12.3651    24.8343 
   H 166    6.4222    12.7982     9.4700    15.4443     9.2900    22.8188 
   H 167    7.5974    13.9716    10.6448    16.6034    10.4417    23.9178 
   H 168    8.3956    14.7823    11.4290    17.3263    11.1547    24.7902 
   H 169    8.7778    15.1289    11.8339    17.8269    11.6708    24.8922 

              C  61      C  62      C  63      C  64      C  65      C  66
              ------------------------------------------------------------------
   C  61    0.0000 
   C  62    1.7320     0.0000 
   C  63   16.0221    14.3015     0.0000 
   C  64    4.8530     6.3805    20.0353     0.0000 
   C  65    5.5229     4.6505    13.8924    10.2340     0.0000 
   C  66    1.0000     1.0000    15.1125     5.3866     5.4676     0.0000 
   C  67    1.0000     2.0000    16.1609     5.4574     4.7794     1.7320 
   C  68    5.7644     7.3371    21.0335     1.0000    11.0516     6.3491 
   C  69    2.6458     4.0000    17.6623     2.4347     8.1670     3.0000 
   C  70    6.5828     8.0837    21.5013     1.7320    11.9558     7.0856 
   C  71    7.4840     9.0260    22.5012     2.6458    12.7806     8.0313 
   C  72    8.3135     9.7970    23.0043     3.4641    13.6802     8.7975 
   C  73    9.2083    10.7287    24.0041     4.3589    14.5103     9.7310 
   C  74    9.3468    10.9413    24.5009     4.5825    14.4963     9.9544 
   C  75   10.0447    11.5160    24.5376     5.1961    15.4063    10.5160 
   C  76   10.9350    12.4395    25.5361     6.0828    16.2406    11.4404 
   C  77   11.0519    12.6233    26.0036     6.2449    16.2281    11.6310 
   C  78   11.7762    13.2383    26.0957     6.9282    17.1336    12.2384 
   C  79   12.6631    14.1554    27.0921     7.8102    17.9711    13.1557 
   C  80   12.7643    14.3172    27.5333     7.9372    17.9598    13.3219 
   C  81   12.2228    13.8593    27.5007     7.5498    17.1857    12.8832 
   H  82    8.8542     7.1224     7.3159    13.2289     6.8609     8.0120 
   H  83    8.7782     7.0462     7.3568    13.1290     6.8828     7.9280 
   H  84    6.3202     4.6786    10.4414    11.0566     3.7111     5.6700 
   H  85    6.8609     5.1500     9.1655    11.0164     6.2429     5.9475 
   H  86    9.2606     7.5645     7.6363    13.8783     6.2577     8.5256 
   H  87    9.6712     8.0130     7.8606    14.3759     6.1678     8.9951 
   H  88    8.9247     7.2979     8.6990    13.6765     5.2915     8.2900 
   H  89    8.9741     7.3433     8.6252    13.7209     5.3635     8.3343 
   H  90    8.6077     7.0447     9.4789    13.4162     4.6050     8.0444 
   H  91    7.8022     6.2095     9.7074    12.5883     4.1962     7.2075 
   H  92   10.3794     8.6526     6.0969    14.8247     7.8021     9.5674 
   H  93   10.5290     8.8020     5.9601    14.9709     7.9355     9.7161 
   H  94    7.4318     5.9068    10.3992    12.2585     3.5191     6.9062 
   H  95    6.6109     4.9969     9.6603    10.3755     7.0159     5.6351 
   H  96    6.8165     5.1332     9.2617    10.8297     6.5783     5.8750 
   H  97   11.9610    10.2472     4.0771    15.9730    10.3040    11.0424 
   H  98   11.9049    10.1944     4.1500    15.8904    10.3186    10.9816 
   H  99    9.2420     7.5476     6.8500    13.1954     8.2869     8.3041 
   H 100    8.2386     6.5385     7.8169    12.2659     7.4070     7.3082 
   H 101    7.5792     5.8809     8.4736    11.6263     6.9359     6.6486 
   H 102    5.1005     3.4769    11.0453     9.0475     5.9738     4.1339 
   H 103    5.2004     3.7289    11.2838     8.7521     6.7532     4.2029 
   H 104    6.0624     4.5475    10.4532     9.5940     7.1745     5.0675 
   H 105    5.5176     3.9641    11.4563    10.3257     2.8291     4.9639 
   H 106    9.1810     7.5160     7.0589    12.9829     8.5817     8.2220 
   H 107    9.6421     8.0239     6.9530    13.2159     9.3863     8.6627 
   H 108   10.3808     8.7316     6.0780    14.0557     9.7531     9.4124 
   H 109   12.4577    10.7988     4.2394    16.1068    11.5009    11.4922 
   H 110   11.2064     9.4905     5.7415    15.7279     8.2283    10.4273 
   H 111    4.4726     2.8292    11.6143     8.5496     5.5242     3.5191 
   H 112   12.5652    10.9107     4.2217    16.1880    11.6435    11.5974 
   H 113   14.1413    12.4981     3.4601    17.6619    13.2012    13.1677 
   H 114   14.9694    13.2526     1.0829    18.9557    12.9950    14.0533 
   H 115   13.5399    11.8132     2.5343    17.6652    11.3961    12.6469 
   H 116    3.8917     2.1829    12.2658     8.5299     3.8796     3.1512 
   H 117    3.1022     1.4156    13.0506     7.7924     3.8722     2.4059 
   H 118    6.5914     5.3199    12.1304    11.4348     1.8396     6.2750 
   H 119   13.4687    11.7372     2.8441    17.7035    11.0576    12.6006 
   H 120   13.2491    11.5187     3.5191    17.6103    10.5178    12.4156 
   H 121   12.3952    10.6638     4.0841    16.7366     9.8233    11.5537 
   H 122    2.1170     3.7433    17.8301     2.7536     7.5000     2.7900 
   H 123   15.0113    13.2852     1.1121    19.1070    12.7835    14.1153 
   H 124   14.7419    13.0103     1.8397    18.9641    12.2321    13.8732 
   H 125   13.9024    12.1719     2.3521    18.0964    11.5477    13.0254 
   H 126    1.0828     2.7609    17.0611     4.3366     5.9011     2.0791 
   H 127    2.8851     4.6043    18.9047     3.2982     7.3858     3.8345 
   H 128    4.4856     6.2175    20.4834     2.6037     9.0415     5.3709 
   H 129    3.9345     5.4202    19.0846     0.9750     9.3818     4.4234 
   H 130   15.6588    14.0025     2.7431    19.2124    14.4922    14.6903 
   H 131    2.8292     1.4158    13.3442     6.8509     5.5130     1.8397 
   H 132    1.8500     3.4601    17.5490     3.0061     7.2747     2.5045 
   H 133    4.6540     3.4822    13.1623     9.4924     1.4158     4.3954 
   H 134    1.4956     3.0148    17.2580     4.6828     5.6306     2.4825 
   H 135    2.3716     3.8242    17.9756     4.8468     5.8287     3.3533 
   H 136    2.5558     4.2047    18.4833     4.0109     6.6709     3.5505 
   H 137   13.5595    11.9973     5.1725    16.7303    13.3074    12.5655 
   H 138   14.4263    12.8554     4.8212    17.6039    14.0536    13.4334 
   H 139   14.3242    12.7098     4.0019    17.6988    13.6264    13.3407 
   H 140    1.8396     0.6200    14.3897     6.6587     4.0795     1.4157 
   H 141   16.5913    14.8740     0.6200    20.5607    14.5109    15.6752 
   H 142   16.2822    14.5554     0.6200    20.3754    13.9508    15.3879 
   H 143   15.4569    13.7331     0.6200    19.5154    13.2741    14.5545 
   H 144    4.8560     6.2832    19.7001     0.6200    10.3252     5.2832 
   H 145    1.4158     1.4158    15.0747     5.1745     6.0224     0.6201 
   H 146    6.1035     5.1495    13.5543    10.8396     0.6200     6.0021 
   H 147    5.7803     5.0606    14.4099    10.3884     0.6201     5.8205 
   H 148    4.9518     4.1839    14.2495     9.6302     0.6201     4.9530 
   H 149    4.4416     6.1364    20.4314     3.6991     8.3937     5.4100 
   H 150    5.4300     7.1615    21.4131     2.7929     9.9315     6.3024 
   H 151    1.1766     1.4956    15.5502     5.9360     4.3562     1.5200 
   H 152    1.6199     2.3716    16.2772     5.8865     4.3701     2.2900 
   H 153    1.1766     2.5558    16.7722     5.0099     5.2419     2.1114 
   H 154    5.8811     7.5136    21.3803     1.4158    11.0295     6.5423 
   H 155    2.5121     4.0477    17.9723     2.3480     7.9678     3.0634 
   H 156    3.2380     4.6200    18.2064     1.8441     8.7492     3.6200 
   H 157    2.9083     4.0478    17.3690     2.6666     8.4073     3.0634 
   H 158    6.5850     8.0070    21.1893     1.8396    12.0339     7.0073 
   H 159    7.5743     9.1701    22.8256     2.8292    12.7615     8.1849 
   H 160    8.3153     9.7339    22.7130     3.5191    13.7485     8.7346 
   H 161    8.7391    10.3432    23.9705     4.0018    13.8765     9.3591 
   H 162    9.4849    11.1164    24.8242     4.8212    14.5224    10.1402 
   H 163    9.9561    11.5417    25.0354     5.1723    15.1162    10.5525 
   H 164   13.1843    14.6533    27.4504     8.3333    18.5220    13.6533 
   H 165   13.3414    14.9059    28.1526     8.5255    18.5044    13.9119 
   H 166   10.4527    12.0961    25.8236     5.8192    15.4246    11.1237 
   H 167   11.6268    13.2713    26.9696     6.9852    16.5693    12.2987 
   H 168   12.4038    14.0642    27.8226     7.8169    17.2616    13.0984 
   H 169   12.8210    14.4499    28.0354     8.1225    17.8024    13.4708 

              C  67      C  68      C  69      C  70      C  71      C  72
              ------------------------------------------------------------------
   C  67    0.0000 
   C  68    6.2984     0.0000 
   C  69    3.4641     3.4266     0.0000 
   C  70    7.1834     1.0000     4.0967     0.0000 
   C  71    8.0304     1.7320     5.0594     1.0000     0.0000 
   C  72    8.9117     2.6457     5.7998     1.7320     1.0000     0.0000 
   C  73    9.7625     3.4641     6.7419     2.6458     1.7320     1.0001 
   C  74    9.8111     3.6055     7.0160     2.9999     1.9999     1.7321 
   C  75   10.6413     4.3588     7.5162     3.4641     2.6457     1.7320 
   C  76   11.4945     5.1961     8.4444     4.3589     3.4641     2.6458 
   C  77   11.5359     5.2914     8.6648     4.5825     3.6055     3.0000 
   C  78   12.3715     6.0827     9.2384     5.1961     4.3588     3.4641 
   C  79   13.2265     6.9282    10.1569     6.0827     5.1961     4.3589 
   C  80   13.2625     6.9999    10.3409     6.2449     5.2914     4.5826 
   C  81   12.6063     6.5574     9.9833     6.0000     5.0000     4.5827 
   H  82    8.8959    14.2238    10.7975    14.8277    15.8169    16.4535 
   H  83    8.8350    14.1248    10.6989    14.7226    15.7128    16.3443 
   H  84    6.1222    12.0157     8.6562    12.7511    13.7011    14.4545 
   H  85    7.0656    12.0153     8.5978    12.5822    13.5764    14.1867 
   H  86    9.1307    14.8576    11.4489    15.5356    16.5074    17.2076 
   H  87    9.4577    15.3439    11.9593    16.0553    17.0160    17.7449 
   H  88    8.6667    14.6349    11.2746    15.3703    16.3210    17.0716 
   H  89    8.7219    14.6804    11.3170    15.4131    16.3650    17.1132 
   H  90    8.2697    14.3576    11.0437    15.1268    16.0614    16.8417 
   H  91    7.5107    13.5370    10.2039    14.2930    15.2340    16.0036 
   H  92   10.3566    15.8176    12.3911    16.4337    17.4210    18.0655 
   H  93   10.5065    15.9640    12.5375    16.5784    17.5660    18.2087 
   H  94    7.0684    13.1912     9.9053    13.9757    14.9015    15.6961 
   H  95    6.9906    11.3742     8.0068    11.8649    12.8646    13.4127 
   H  96    7.0887    11.8297     8.4268    12.3665    13.3637    13.9490 
   H  97   12.1355    16.9722    13.5911    17.4607    18.4606    18.9898 
   H  98   12.0910    16.8892    13.5130    17.3715    18.3715    18.8952 
   H  99    9.4804    14.1947    10.8136    14.6907    15.6904    16.2330 
   H 100    8.4664    13.2659     9.8684    13.7887    14.7872    15.3559 
   H 101    7.8144    12.6262     9.2231    13.1608    14.1583    14.7391 
   H 102    5.4719    10.0472     6.6400    10.5997    11.5950    12.2003 
   H 103    5.7153     9.7499     6.3988    10.2340    11.2337    11.7843 
   H 104    6.5442    10.5897     7.2581    11.0495    12.0495    12.5753 
   H 105    5.2270    11.2654     7.9636    12.0393    12.9704    13.7574 
   H 106    9.4798    13.9800    10.6272    14.4429    15.4429    15.9573 
   H 107   10.0120    14.2063    10.9095    14.6155    15.6132    16.0799 
   H 108   10.7041    15.0484    11.7324    15.4710    16.4694    16.9451 
   H 109   12.7618    17.0963    13.7999    17.4946    18.4910    18.9391 
   H 110   11.1255    16.7168    13.2932    17.3541    18.3371    18.9990 
   H 111    4.8212     9.5473     6.1257    10.1357    11.1260    11.7629 
   H 112   12.8768    17.1764    13.8877    17.5678    18.5636    19.0054 
   H 113   14.4699    18.6440    15.3933    19.0004    19.9918    20.3982 
   H 114   15.1264    19.9537    16.5858    20.4190    21.4189    21.9215 
   H 115   13.6499    18.6651    15.2683    19.1744    20.1738    20.7184 
   H 116    3.8982     9.4983     6.1177    10.2144    11.1711    11.9124 
   H 117    3.1102     8.7519     5.3984     9.4901    10.4372    11.1982 
   H 118    6.0370    12.3161     9.1977    13.1668    14.0462    14.8987 
   H 119   13.5288    18.7032    15.2909    19.2432    20.2410    20.8131 
   H 120   13.2464    18.6076    15.1837    19.1859    20.1797    20.7863 
   H 121   12.4105    17.7342    14.3110    18.3099    19.3039    19.9096 
   H 122    2.7217     3.6481     1.0483     4.4856     5.3709     6.2175 
   H 123   15.1225    20.1066    16.7175    20.6011    21.6010    22.1298 
   H 124   14.7980    19.9640    16.5548    20.4952    21.4937    22.0560 
   H 125   13.9782    19.0964    15.6899    19.6230    20.6216    21.1811 
   H 126    1.1500     5.1566     2.5343     6.0549     6.8882     7.7793 
   H 127    2.9052     3.8700     2.6858     4.8548     5.5378     6.5007 
   H 128    4.6050     2.7434     3.3780     3.7288     4.2012     5.1989 
   H 129    4.6050     1.9689     1.4597     2.6655     3.6098     4.3884 
   H 130   15.9643    20.1945    16.9413    20.5488    21.5396    21.9406 
   H 131    3.3533     7.8451     4.4187     8.4687     9.4514    10.1242 
   H 132    2.5045     3.9158     1.0828     4.7376     5.6340     6.4693 
   H 133    4.0995    10.3726     7.2734    11.2244    12.1026    12.9564 
   H 134    1.1121     5.4409     3.0634     6.3742     7.1627     8.0828 
   H 135    1.8397     5.4829     3.6200     6.4589     7.1616     8.1206 
   H 136    2.3520     4.6147     3.0634     5.5959     6.2867     7.2485 
   H 137   13.9955    17.6939    14.5520    17.9777    18.9571    19.3001 
   H 138   14.8521    18.5663    15.4287    18.8443    19.8221    20.1572 
   H 139   14.6954    18.6731    15.4688    18.9952    19.9814    20.3564 
   H 140    1.7732     7.5888     4.3433     8.3807     9.2999    10.1061 
   H 141   16.7439    21.5579    18.1973    22.0116    23.0111    23.5006 
   H 142   16.3860    21.3748    17.9883    21.8635    22.8635    23.3852 
   H 143   15.5807    20.5145    17.1331    20.9969    21.9969    22.5142 
   H 144    5.5512     1.4158     2.2833     1.8397     2.8292     3.5191 
   H 145    2.2901     6.1596     2.7430     6.8340     7.8019     8.5224 
   H 146    5.3826    11.6632     8.7492    12.5634    13.3930    14.2892 
   H 147    4.9677    11.1721     8.4073    12.0975    12.8937    13.8123 
   H 148    4.1810    10.4408     7.5906    11.3495    12.1688    13.0721 
   H 149    4.3099     3.8748     4.0133     4.8559     5.2831     6.2831 
   H 150    5.5512     2.5783     4.1257     3.4691     3.7258     4.7190 
   H 151    0.6200     6.8085     3.8121     7.6676     8.5388     9.3993 
   H 152    0.6200     6.6833     4.0130     7.5981     8.4111     9.3172 
   H 153    0.6200     5.8097     3.1995     6.7216     7.5388     8.4415 
   H 154    6.3266     0.6200     3.7208     1.4158     1.8397     2.8292 
   H 155    3.1995     3.2898     0.6200     4.0735     4.9903     5.8028 
   H 156    4.0130     2.8429     0.6200     3.4814     4.4499     5.1807 
   H 157    3.8121     3.6646     0.6200     4.2121     5.2019     5.8628 
   H 158    7.2548     1.4157     4.0085     0.6200     1.4158     1.8397 
   H 159    8.0525     1.8397     5.2631     1.4158     0.6200     1.4158 
   H 160    8.9695     2.8292     5.7379     1.8397     1.4158     0.6200 
   H 161    9.1944     3.0147     6.4364     2.4824     1.4955     1.5201 
   H 162    9.8922     3.8242     7.2504     3.3532     2.3716     2.2901 
   H 163   10.4282     4.2047     7.6020     3.5504     2.5558     2.1115 
   H 164   13.7674     7.4715    10.6533     6.6018     5.7414     4.8708 
   H 165   13.8235     7.5792    10.9364     6.8428     5.8808     5.1928 
   H 166   10.8333     4.8212     8.2462     4.3432     3.3532     3.1408 
   H 167   11.9990     5.9889     9.4153     5.4718     4.4738     4.1339 
   H 168   12.7426     6.8179    10.2406     6.3328     5.3371     5.0105 
   H 169   13.2147     7.1345    10.5571     6.5442     5.5455     5.0675 

              C  73      C  74      C  75      C  76      C  77      C  78
              ------------------------------------------------------------------
   C  73    0.0000 
   C  74    1.0000     0.0000 
   C  75    1.0000     1.7321     0.0000 
   C  76    1.7320     2.0000     1.0001     0.0000 
   C  77    1.9999     1.7320     1.7321     1.0000     0.0000 
   C  78    2.6457     3.0000     1.7320     1.0000     1.7321     0.0000 
   C  79    3.4641     3.6056     2.6458     1.7320     2.0001     1.0000 
   C  80    3.6055     3.4641     3.0000     1.9999     1.7320     1.7321 
   C  81    3.6055     3.0001     3.4642     2.6457     1.7321     3.0001 
   H  82   17.4365    17.7989    18.0990    19.0759    19.4077    19.7594 
   H  83   17.3285    17.6965    17.9866    18.9647    19.3015    19.6444 
   H  84   15.3969    15.6198    16.1640    17.0999    17.3009    17.8779 
   H  85   15.1746    15.5669    15.8181    16.7994    17.1545    17.4689 
   H  86   18.1726    18.4600    18.8905    19.8492    20.1127    20.5815 
   H  87   18.6990    18.9493    19.4419    20.3902    20.6200    21.1447 
   H  88   18.0159    18.2383    18.7786    19.7173    19.9207    20.4899 
   H  89   18.0587    18.2843    18.8192    19.7590    19.9653    20.5296 
   H  90   17.7706    17.9516    18.5599    19.4838    19.6491    20.2804 
   H  91   16.9382    17.1360    17.7184    18.6475    18.8273    19.4362 
   H  92   19.0470    19.3994    19.7144    20.6902    21.0151    21.3765 
   H  93   19.1907    19.5450    19.8563    20.8326    21.1595    21.5172 
   H  94   16.6164    16.7787    17.4189    18.3345    18.4817    19.1433 
   H  95   14.4091    14.8640    15.0008    15.9921    16.4032    16.6178 
   H  96   14.9411    15.3592    15.5635    16.5494    16.9278    17.2009 
   H  97   19.9883    20.4604    20.5511    21.5470    21.9856    22.1379 
   H  98   19.8941    20.3714    20.4522    21.4485    21.8919    22.0354 
   H  99   17.2303    17.6898    17.8103    18.8038    19.2257    19.4140 
   H 100   16.3505    16.7846    16.9553    17.9448    18.3412    18.5784 
   H 101   15.7319    16.1542    16.3486    17.3358    17.7199    17.9809 
   H 102   13.1886    13.5875    13.8327    14.8134    15.1696    15.4868 
   H 103   12.7802    13.2332    13.3793    14.3690    14.7734    15.0047 
   H 104   13.5734    14.0494    14.1487    15.1422    15.5703    15.7554 
   H 105   14.6818    14.8596    15.4786    16.3975    16.5568    17.2020 
   H 106   16.9565    17.4427    17.5122    18.5085    18.9549    19.0976 
   H 107   17.0799    17.6093    17.5931    18.5924    19.0798    19.1434 
   H 108   17.9452    18.4667    18.4642    19.4632    19.9451    20.0178 
   H 109   19.9386    20.4847    20.4285    21.4285    21.9375    21.9535 
   H 110   19.9762    20.3081    20.6581    21.6297    21.9366    22.3283 
   H 111   12.7446    13.1110    13.4165    14.3896    14.7151    15.0877 
   H 112   20.0046    20.5562    20.4886    21.4887    22.0031    22.0082 
   H 113   21.3950    21.9769    21.8439    22.8433    23.3893    23.3287 
   H 114   22.9213    23.4185    23.4556    24.4541    24.9208    25.0157 
   H 115   21.7159    22.1729    22.2901    23.2847    23.7114    23.8840 
   H 116   12.8595    13.1038    13.6191    14.5582    14.7744    15.3315 
   H 117   12.1357    12.3564    12.9128    13.8426    14.0364    14.6315 
   H 118   15.7767    15.8480    16.6307    17.5075    17.5718    18.3627 
   H 119   21.8079    22.2370    22.4070    23.3981    23.7986    24.0200 
   H 120   21.7760    22.1689    22.4064    23.3917    23.7578    24.0421 
   H 121   20.8993    21.2936    21.5298    22.5149    22.8814    23.1662 
   H 122    7.0982     7.2317     7.9495     8.8273     8.9350     9.6815 
   H 123   23.1286    23.6007    23.6866    24.6832    25.1261    25.2663 
   H 124   23.0520    23.4909    23.6407    24.6335    25.0447    25.2448 
   H 125   22.1773    22.6193    22.7644    23.7574    24.1705    24.3680 
   H 126    8.6199     8.6612     9.5065    10.3518    10.3861    11.2352 
   H 127    7.2359     7.1319     8.1823     8.9470     8.8631     9.8813 
   H 128    5.8116     5.5806     6.7935     7.4766     7.2984     8.4425 
   H 129    5.3089     5.5571     6.1166     7.0242     7.2135     7.8464 
   H 130   22.9368    23.5236    23.3779    24.3769    24.9299    24.8528 
   H 131   11.0956    11.4258    11.8018    12.7630    13.0511    13.4931 
   H 132    7.3587     7.5056     8.2013     9.0862     9.2056     9.9332 
   H 133   13.8331    13.9084    14.6885    15.5640    15.6309    16.4205 
   H 134    8.8886     8.8686     9.7996    10.6164    10.5997    11.5210 
   H 135    8.8609     8.7424     9.8066    10.5708    10.4716    11.5063 
   H 136    7.9843     7.8700     8.9312     9.6941     9.6001    10.6298 
   H 137   20.2896    20.9216    20.6831    21.6787    22.2713    22.1153 
   H 138   21.1454    21.7838    21.5296    22.5241    23.1245    22.9506 
   H 139   21.3501    21.9575    21.7705    22.7683    23.3388    23.2276 
   H 140   11.0176    11.1799    11.8335    12.7391    12.8798    13.5621 
   H 141   24.5006    25.0102    25.0209    26.0201    26.5005    26.5671 
   H 142   24.3843    24.8634    24.9344    25.9317    26.3826    26.5062 
   H 143   23.5135    23.9969    24.0605    25.0581    25.5122    25.6307 
   H 144    4.4726     4.8212     5.2329     6.1648     6.4221     6.9558 
   H 145    9.4762     9.7570    10.2254    11.1681    11.4073    11.9368 
   H 146   15.1233    15.1142    16.0163    16.8540    16.8458    17.7444 
   H 147   14.6177    14.5615    15.5309    16.3434    16.2932    17.2523 
   H 148   13.8978    13.8786    14.7970    15.6275    15.6104    16.5233 
   H 149    6.8417     6.5247     7.8342     8.4679     8.2140     9.4483 
   H 150    5.2073     4.8554     6.2051     6.8081     6.5429     7.7934 
   H 151   10.2697    10.3512    11.1311    12.0009    12.0708    12.8630 
   H 152   10.1404    10.1379    11.0404    11.8705    11.8683    12.7660 
   H 153    9.2689     9.2810    10.1656    10.9997    11.0099    11.8920 
   H 154    3.5192     3.4848     4.4726     5.2330     5.2100     6.1647 
   H 155    6.7069     6.8936     7.5334     8.4299     8.5791     9.2646 
   H 156    6.1255     6.4158     6.8963     7.8257     8.0550     8.6185 
   H 157    6.8331     7.1899     7.5500     8.5042     8.7935     9.2538 
   H 158    2.8293     3.3532     3.5192     4.4727     4.8212     5.2330 
   H 159    1.8397     1.7732     2.8292     3.5192     3.4848     4.4726 
   H 160    1.4158     2.2901     1.8397     2.8293     3.3533     3.5191 
   H 161    1.1766     0.6200     2.1115     2.5559     2.3521     3.5505 
   H 162    1.6200     0.6200     2.2901     2.3715     1.8396     3.3532 
   H 163    1.1766     0.6200     1.5201     1.4956     1.1120     2.4825 
   H 164    4.0130     4.2101     3.1408     2.2900     2.6201     1.4158 
   H 165    4.2100     4.0131     3.6201     2.6200     2.2901     2.2901 
   H 166    2.2900     1.4158     2.6200     2.2901     1.4158     3.1408 
   H 167    3.1879     2.4825     3.1995     2.5121     1.5200     3.0634 
   H 168    4.0601     3.3533     4.0131     3.2380     2.2901     3.6201 
   H 169    4.0750     3.5505     3.8121     2.9082     2.1114     3.0634 

              C  79      C  80      C  81      H  82      H  83      H  84
              ------------------------------------------------------------------
   C  79    0.0000 
   C  80    1.0001     0.0000 
   C  81    2.6458     1.7320     0.0000 
   H  82   20.7303    21.0361    20.7785     0.0000 
   H  83   20.6165    20.9268    20.6780     0.1500     0.0000 
   H  84   18.8082    18.9911    18.5301     3.2043     3.2078     0.0000 
   H  85   18.4437    18.7678    18.5566     2.3099     2.1853     2.7528 
   H  86   21.5346    21.7777    21.4055     1.5852     1.7262     3.0262 
   H  87   22.0877    22.3001    21.8720     2.4590     2.6015     3.3522 
   H  88   21.4235    21.6109    21.1432     2.6647     2.7845     2.6199 
   H  89   21.4643    21.6545    21.1913     2.6200     2.7417     2.6647 
   H  90   21.2001    21.3521    20.8256     3.3523     3.4581     2.4590 
   H  91   20.3605    20.5254    20.0249     3.0263     3.1024     1.5852 
   H  92   22.3467    22.6479    22.3744     1.6179     1.7385     4.3895 
   H  93   22.4880    22.7912    22.5206     1.7578     1.8755     4.5357 
   H  94   20.0550    20.1897    19.6401     3.6748     3.7403     1.5505 
   H  95   17.6032    17.9775    17.8635     3.3980     3.2569     3.8197 
   H  96   18.1805    18.5256    18.3543     2.6592     2.5242     3.1804 
   H  97   23.1302    23.5395    23.4603     3.4641     3.4673     6.6684 
   H  98   23.0282    23.4419    23.3714     3.4673     3.4641     6.6701 
   H  99   20.4029    20.7924    20.6893     1.8755     1.7578     4.5826 
   H 100   19.5624    19.9267    19.7817     1.7000     1.5505     3.7403 
   H 101   18.9622    19.3140    19.1499     2.0000     1.8548     3.3432 
   H 102   16.4600    16.7814    16.5799     4.2750     4.1580     3.4103 
   H 103   15.9876    16.3521    16.2328     4.8521     4.7225     4.2839 
   H 104   16.7431    17.1313    17.0494     4.2796     4.1404     4.3071 
   H 105   18.1162    18.2606    17.7390     4.2048     4.2005     1.0149 
   H 106   20.0899    20.5019    20.4426     2.4183     2.2908     4.9066 
   H 107   20.1402    20.5910    20.6049     3.2756     3.1534     5.7384 
   H 108   21.0144    21.4615    21.4638     3.2350     3.1409     6.0530 
   H 109   22.9523    23.4283    23.4775     4.6821     4.6387     7.7956 
   H 110   23.2946    23.5799    23.2739     2.5982     2.7283     5.0507 
   H 111   16.0529    16.3453    16.0955     4.6926     4.5870     3.3452 
   H 112   23.0073    23.4886    23.5476     4.8288     4.7843     7.9372 
   H 113   24.3287    24.8421    24.9592     6.3539     6.3219     9.5037 
   H 114   26.0118    26.4511    26.4183     6.3219     6.3539     9.4824 
   H 115   24.8751    25.2751    25.1718     4.7843     4.8288     7.9102 
   H 116   16.2639    16.4577    16.0340     5.0025     4.9385     2.5474 
   H 117   15.5549    15.7277    15.2743     5.7979     5.7324     3.2644 
   H 118   19.2385    19.2971    18.6268     5.2966     5.3423     2.4195 
   H 119   25.0071    25.3823    25.2324     4.6329     4.6972     7.6640 
   H 120   25.0229    25.3655    25.1560     4.4038     4.4922     7.2591 
   H 121   24.1466    24.4887    24.2814     3.5426     3.6263     6.4712 
   H 122   10.5574    10.6476    10.1230    10.7940    10.7069     8.4072 
   H 123   26.2599    26.6768    26.6006     6.2498     6.2977     9.3506 
   H 124   26.2340    26.6205    26.4876     5.9028     5.9690     8.9019 
   H 125   25.3573    25.7447    25.6166     5.0845     5.1432     8.1412 
   H 126   12.0837    12.1131    11.4618     9.8536     9.7834     7.1939 
   H 127   10.6649    10.5946     9.8061    11.7085    11.6377     9.0221 
   H 128    9.1664     9.0217     8.1476    13.3397    13.2637    10.7117 
   H 129    8.7460     8.8988     8.5241    12.2554    12.1560    10.0923 
   H 130   25.8528    26.3749    26.5042     7.6334     7.6199    10.8264 
   H 131   14.4456    14.7008    14.4008     6.3788     6.2808     4.4995 
   H 132   10.8151    10.9156    10.4032    10.5085    10.4216     8.1270 
   H 133   17.2950    17.3553    16.7004     5.9355     5.9325     2.7350 
   H 134   12.3454    12.3310    11.6050    10.0032     9.9408     7.2275 
   H 135   12.2869    12.2017    11.3641    10.6897    10.6344     7.8111 
   H 136   11.4105    11.3309    10.5148    11.2390    11.1751     8.4620 
   H 137   23.1141    23.6708    23.8796     6.6545     6.5857     9.6044 
   H 138   23.9487    24.5143    24.7380     7.3214     7.2636    10.3438 
   H 139   24.2273    24.7643    24.9289     6.8139     6.7706     9.9180 
   H 140   14.4631    14.5872    14.0623     7.1381     7.0735     4.4862 
   H 141   27.5647    28.0186    28.0091     7.9157     7.9535    11.0513 
   H 142   27.5010    27.9267    27.8634     7.5029     7.5551    10.5733 
   H 143   26.6256    27.0535    26.9969     6.7197     6.7642     9.8327 
   H 144    7.8742     8.0773     7.8169    12.9889    12.8842    10.9355 
   H 145   12.8706    13.0788    12.7160     8.0845     7.9911     5.9415 
   H 146   18.5849    18.5775    17.8057     6.6510     6.6855     3.5947 
   H 147   18.0704    18.0250    17.1968     7.4385     7.4649     4.3117 
   H 148   17.3577    17.3423    16.5657     7.1189     7.1286     3.9232 
   H 149   10.1293     9.9180     8.9200    13.1965    13.1317    10.4081 
   H 150    8.4607     8.2488     7.2881    14.2838    14.2067    11.6612 
   H 151   13.7323    13.7934    13.1722     8.2791     8.2194     5.5072 
   H 152   13.6010    13.5992    12.8773     8.9778     8.9265     6.0793 
   H 153   12.7308    12.7396    12.0457     9.5131     9.4513     6.7381 
   H 154    6.9559     6.9386     6.3470    14.4913    14.3967    12.1831 
   H 155   10.1559    10.2801     9.8209    11.0111    10.9187     8.7263 
   H 156    9.5373     9.7263     9.3919    11.3867    11.2862     9.2744 
   H 157   10.1957    10.4382    10.1809    10.6158    10.5111     8.6301 
   H 158    6.1648     6.4222     6.3328    14.6139    14.5046    12.6462 
   H 159    5.2330     5.2100     4.7206    16.0579    15.9577    13.8482 
   H 160    4.4726     4.8212     5.0105    16.2611    16.1483    14.3621 
   H 161    4.2048     4.0841     3.5506    17.2288    17.1279    15.0208 
   H 162    3.8242     3.5191     2.7431    18.0478    17.9489    15.7883 
   H 163    3.0148     2.8441     2.4825    18.3722    18.2683    16.2203 
   H 164    0.6200     1.4158     3.1408    21.1619    21.0460    19.2936 
   H 165    1.4158     0.6201     1.8397    21.6453    21.5365    19.5819 
   H 166    3.3533     2.8292     1.7733    19.0435    18.9452    16.7636 
   H 167    2.9083     2.1114     0.6200    20.2127    20.1136    17.9386 
   H 168    3.2380     2.2901     0.6200    21.0363    20.9389    18.7221 
   H 169    2.5121     1.5200     0.6200    21.3471    21.2454    19.1235 

              H  85      H  86      H  87      H  88      H  89      H  90
              ------------------------------------------------------------------
   H  85    0.0000 
   H  86    3.4903     0.0000 
   H  87    4.2936     0.8768     0.0000 
   H  88    4.0605     1.2399     0.8768     0.0000 
   H  89    4.0541     1.1766     0.8057     0.0738     0.0000 
   H  90    4.4237     2.0318     1.6200     0.8057     0.8768     0.0000 
   H  91    3.6924     2.0738     2.0318     1.1766     1.2399     0.8768 
   H  92    3.9239     1.5747     2.0751     2.7614     2.6911     3.5670 
   H  93    4.0602     1.6962     2.1529     2.8651     2.7939     3.6707 
   H  94    4.0604     2.7696     2.6598     1.7840     1.8542     1.2096 
   H  95    1.2708     4.7202     5.5436     5.3312     5.3247     5.6807 
   H  96    0.4839     3.9299     4.7482     4.5385     4.5307     4.9076 
   H  97    5.1001     4.2930     4.8513     5.5188     5.4506     6.3206 
   H  98    5.0449     4.3470     4.9250     5.5776     5.5102     6.3774 
   H  99    2.4185     3.4273     4.2815     4.5400     4.4955     5.2125 
   H 100    1.4038     3.2512     4.1272     4.1880     4.1573     4.7588 
   H 101    0.7700     3.4230     4.2801     4.2043     4.1846     4.6849 
   H 102    1.9864     5.2693     5.9832     5.5549     5.5686     5.6955 
   H 103    2.5483     5.9832     6.7356     6.3582     6.3676     6.5379 
   H 104    2.0660     5.5549     6.3582     6.0845     6.0841     6.3676 
   H 105    3.4263     4.0028     4.2403     3.4397     3.4950     3.0923 
   H 106    2.4977     3.9889     4.8501     5.0734     5.0318     5.7217 
   H 107    3.2041     4.8301     5.6810     5.9379     5.8947     6.5953 
   H 108    3.7365     4.6830     5.4868     5.8670     5.8154     6.5831 
   H 109    5.7355     5.8050     6.4552     7.0450     6.9812     7.8302 
   H 110    4.9072     2.0351     2.1192     2.9671     2.8934     3.7384 
   H 111    2.4759     5.5423     6.1984     5.6904     5.7123     5.7398 
   H 112    5.8587     5.9550     6.6045     7.1950     7.1312     7.9801 
   H 113    7.4621     7.3557     7.9286     8.5883     8.5211     9.3870 
   H 114    8.1092     6.7604     7.0631     7.8745     7.8012     8.6684 
   H 115    6.7053     5.1569     5.4702     6.2741     6.2008     7.0701 
   H 116    3.2524     5.3817     5.8461     5.1596     5.2008     4.9806 
   H 117    3.9866     6.1606     6.5977     5.8843     5.9290     5.6500 
   H 118    5.1672     4.5015     4.3452     3.4720     3.5449     2.7672 
   H 119    6.6952     4.7999     5.0224     5.8557     5.7820     6.6384 
   H 120    6.6038     4.2932     4.3916     5.2519     5.1784     6.0101 
   H 121    5.7277     3.5670     3.7877     4.6165     4.5427     5.4012 
   H 122    8.6837    11.3063    11.7513    11.0206    11.0684    10.7202 
   H 123    8.1707     6.5264     6.7502     7.5871     7.5134     8.3679 
   H 124    7.9622     5.9866     6.1221     6.9792     6.9056     7.7412 
   H 125    7.1025     5.2900     5.5129     6.3475     6.2738     7.1296 
   H 126    7.9103    10.1797    10.5418     9.7656     9.8190     9.3918 
   H 127    9.7457    12.0208    12.3619    11.5718    11.6271    11.1652 
   H 128   11.3181    13.7002    14.0562    13.2709    13.3256    12.8694 
   H 129   10.0476    12.9048    13.4065    12.7121    12.7558    12.4618 
   H 130    8.9250     8.4637     8.9393     9.6686     9.5982    10.4743 
   H 131    4.2048     7.0890     7.6645     7.0548     7.0881     6.9576 
   H 132    8.4005    11.0223    11.4699    10.7416    10.7890    10.4461 
   H 133    4.9952     5.6226     5.7259     4.8686     4.9338     4.3308 
   H 134    8.1412    10.2399    10.5564     9.7580     9.8143     9.3412 
   H 135    8.9019    10.8365    11.1016    10.2807    10.3402     9.8143 
   H 136    9.3506    11.4773    11.7845    10.9797    11.0369    10.5458 
   H 137    7.2297     7.9160     8.6103     9.1511     9.0905     9.9190 
   H 138    8.0368     8.5011     9.1511     9.7409     9.6776    10.5231 
   H 139    7.7548     7.8950     8.5010     9.1329     9.0672     9.9260 
   H 140    5.2966     7.4502     7.8384     7.0860     7.1359     6.7717 
   H 141    9.7312     8.2553     8.4799     9.3189     9.2451    10.0983 
   H 142    9.4438     7.6973     7.8533     8.7085     8.6348     9.4728 
   H 143    8.6074     7.0175     7.2415     8.0791     8.0053     8.8595 
   H 144   10.7475    13.7004    14.2283    13.5525    13.5942    13.3270 
   H 145    5.9355     8.7059     9.2233     8.5535     8.5939     8.3590 
   H 146    6.2447     5.9230     5.7616     4.8911     4.9643     4.1671 
   H 147    6.8623     6.7745     6.6337     5.7617     5.8346     5.0429 
   H 148    6.3022     6.6337     6.6073     5.7312     5.8017     5.0810 
   H 149   11.2864    13.4277    13.7189    12.9049    12.9635    12.4472 
   H 150   12.2494    14.6503    15.0049    14.2179    14.2729    13.8111 
   H 151    6.4713     8.5127     8.8466     8.0608     8.1152     7.6774 
   H 152    7.2591     9.1045     9.3766     8.5617     8.6202     8.1152 
   H 153    7.6640     9.7490    10.0699     9.2745     9.3303     8.8658 
   H 154   12.3130    15.0679    15.5256    14.7967    14.8446    14.4885 
   H 155    8.8567    11.5850    12.0578    11.3452    11.3908    11.0720 
   H 156    9.1725    12.0578    12.5740    11.8923    11.9345    11.6636 
   H 157    8.3770    11.3452    11.8923    11.2378    11.2769    11.0502 
   H 158   12.3474    15.3769    15.9233    15.2600    15.3004    15.0477 
   H 159   13.8405    16.6970    17.1800    16.4664    16.5125    16.1785 
   H 160   13.9789    17.0645    17.6255    16.9725    17.0119    16.7708 
   H 161   15.0063    17.8721    18.3540    17.6384    17.6849    17.3456 
   H 162   15.8370    18.6631    19.1293    18.4023    18.4501    18.0908 
   H 163   16.1318    19.0500    19.5462    18.8395    18.8850    18.5585 
   H 164   18.8685    21.9936    22.5593    21.9055    21.9452    21.6958 
   H 165   19.3794    22.3782    22.8954    22.2018    22.2459    21.9360 
   H 166   16.8355    19.6486    20.1076    19.3751    19.4235    19.0536 
   H 167   17.9996    20.8234    21.2828    20.5497    20.5983    20.2261 
   H 168   18.8332    21.6238    22.0702    21.3283    21.3780    20.9900 
   H 169   19.1174    21.9897    22.4628    21.7381    21.7857    21.4262 

              H  91      H  92      H  93      H  94      H  95      H  96
              ------------------------------------------------------------------
   H  91    0.0000 
   H  92    3.6408     0.0000 
   H  93    3.7672     0.1500     0.0000 
   H  94    0.6980     4.3385     4.4643     0.0000 
   H  95    4.9244     4.9582     5.0823     5.2382     0.0000 
   H  96    4.1730     4.2516     4.3820     4.5278     0.7971     0.0000 
   H  97    6.2803     2.7781     2.7000     6.9717     5.5996     5.1847 
   H  98    6.3174     2.8500     2.7781     7.0064     5.5151     5.1167 
   H  99    4.8022     2.7780     2.8500     5.4003     2.8258     2.4293 
   H 100    4.2136     3.0937     3.2037     4.7432     1.9653     1.4455 
   H 101    4.0450     3.5394     3.6628     4.5040     1.4196     0.7966 
   H 102    4.8441     5.8928     6.0322     4.9571     1.5201     1.7880 
   H 103    5.6955     6.4576     6.5902     5.8284     1.6310     2.2128 
   H 104    5.5686     5.8487     5.9736     5.8042     0.8924     1.6344 
   H 105    2.2905     5.4001     5.5457     1.9436     4.3021     3.7873 
   H 106    5.2638     3.3590     3.4270     5.8348     2.6251     2.3925 
   H 107    6.1399     4.0634     4.1114     6.7065     3.0324     3.0028 
   H 108    6.2346     3.6648     3.6837     6.8507     3.7820     3.6245 
   H 109    7.6709     4.3920     4.3379     8.3409     5.8641     5.6731 
   H 110    4.0352     1.0148     0.9071     4.7100     5.9677     5.2512 
   H 111    4.8690     6.3026     6.4461     4.8892     2.1694     2.3585 
   H 112    7.8195     4.5406     4.4858     8.4890     5.9661     5.7888 
   H 113    9.2969     5.8557     5.7764     9.9784     7.5327     7.3850 
   H 114    8.8335     5.1961     5.0668     9.5300     8.5818     8.1938 
   H 115    7.2302     3.5948     3.4641     7.9265     7.3102     6.8419 
   H 116    4.1190     6.4958     6.6457     3.9173     3.5153     3.3740 
   H 117    4.8057     7.2923     7.4422     4.5348     4.1033     4.0619 
   H 118    2.4280     6.0682     6.1952     1.7321     6.1713     5.5809 
   H 119    6.8675     3.2831     3.1413     7.5578     7.4062     6.8781 
   H 120    6.3233     2.8919     2.7423     7.0000     7.4404     6.8430 
   H 121    5.6306     2.0822     1.9356     6.3196     6.5683     5.9665 
   H 122    9.9082    12.3559    12.5045     9.5477     8.2360     8.5688 
   H 123    8.5966     4.9926     4.8544     9.2880     8.7380     8.2951 
   H 124    8.0359     4.5125     4.3669     8.7177     8.6437     8.1352 
   H 125    7.3585     3.7666     3.6261     8.0492     7.7685     7.2667 
   H 126    8.6187    11.3534    11.5034     8.1952     7.6905     7.8811 
   H 127   10.4143    13.2076    13.3575     9.9604     9.4680     9.6989 
   H 128   12.1156    14.8590    15.0088    11.6648    10.9513    11.2395 
   H 129   11.6296    13.8503    13.9965    11.3104     9.4243     9.8666 
   H 130   10.4777     6.9072     6.8062    11.1707     9.0572     8.8757 
   H 131    6.0847     7.9742     8.1201     5.9368     3.8001     4.0838 
   H 132    9.6317    12.0703    12.2188     9.2761     7.9611     8.2882 
   H 133    3.6952     7.0824     7.2252     3.1269     5.6703     5.2904 
   H 134    8.5966    11.4683    11.6183     8.1355     8.0038     8.1442 
   H 135    9.1084    12.1176    12.2672     8.6047     8.8210     8.9284 
   H 136    9.8143    12.7080    12.8579     9.3376     9.1605     9.3365 
   H 137    9.6801     6.5666     6.5216    10.3260     7.0098     7.0444 
   H 138   10.3355     7.0834     7.0236    10.9951     7.8627     7.8706 
   H 139    9.7951     6.4260     6.3547    10.4685     7.7180     7.6382 
   H 140    5.9628     8.6220     8.7720     5.6025     5.2855     5.3349 
   H 141   10.3267     6.7137     6.5775    11.0189    10.1910     9.8139 
   H 142    9.7554     6.1938     6.0515    10.4403    10.0034     9.5675 
   H 143    9.0881     5.4809     5.3433     9.7797     9.1409     8.7185 
   H 144   12.4863    14.5943    14.7391    12.1875    10.0508    10.5381 
   H 145    7.5060     9.6671     9.8144     7.2518     5.4933     5.8132 
   H 146    3.8492     7.4865     7.6149     3.1552     7.1082     6.6122 
   H 147    4.7026     8.3313     8.4619     4.0131     7.6328     7.1983 
   H 148    4.6009     8.1526     8.2901     3.9475     6.9776     6.6026 
   H 149   11.7348    14.6664    14.8163    11.2376    11.0449    11.2561 
   H 150   13.0612    15.8065    15.9562    12.6055    11.8578    12.1624 
   H 151    6.9089     9.7368     9.8868     6.4801     6.4400     6.5085 
   H 152    7.3924    10.3909    10.5404     6.9065     7.2853     7.3213 
   H 153    8.1152    10.9764    11.1263     7.6617     7.5520     7.6752 
   H 154   13.6819    16.0737    16.2211    13.3091    11.7215    12.1474 
   H 155   10.2482    12.5888    12.7366     9.9114     8.3393     8.7151 
   H 156   10.8233    12.9846    13.1304    10.5251     8.5463     8.9888 
   H 157   10.1971    12.2217    12.3663     9.9379     7.7098     8.1754 
   H 158   14.2033    16.2262    16.3693    13.9134    11.5820    12.1119 
   H 159   15.3629    17.6539    17.8000    15.0060    13.1727    13.6458 
   H 160   15.9235    17.8769    18.0186    15.6407    13.1631    13.7239 
   H 161   16.5326    18.8261    18.9721    16.1706    14.3238    14.8065 
   H 162   17.2867    19.6404    19.7870    16.9083    15.1724    15.6450 
   H 163   17.7405    19.9755    20.1207    17.3876    15.4103    15.9168 
   H 164   20.8519    22.7794    22.9197    20.5578    18.0041    18.5954 
   H 165   21.1123    23.2564    23.3999    20.7703    18.5936    19.1393 
   H 166   18.2546    20.6346    20.7814    17.8674    16.1722    16.6446 
   H 167   19.4284    21.8054    21.9520    19.0387    17.3238    17.8042 
   H 168   20.2001    22.6247    22.7718    19.7979    18.1721    18.6441 
   H 169   20.6228    22.9459    23.0918    20.2425    18.4082    18.9088 

              H  97      H  98      H  99      H 100      H 101      H 102
              ------------------------------------------------------------------
   H  97    0.0000 
   H  98    0.1500     0.0000 
   H  99    2.7781     2.7000     0.0000 
   H 100    3.7403     3.6748     1.0148     0.0000 
   H 101    4.3978     4.3337     1.6674     0.6597     0.0000 
   H 102    6.9685     6.8973     4.2007     3.2326     2.5835     0.0000 
   H 103    7.2288     7.1424     4.4566     3.5760     2.9788     0.8768 
   H 104    6.4156     6.3236     3.6617     2.8476     2.3116     1.2399 
   H 105    7.6669     7.6645     5.4836     4.5826     4.1076     3.5319 
   H 106    3.0404     2.9400     0.5866     1.1751     1.7293     4.0892 
   H 107    3.1353     3.0073     1.4035     2.0000     2.4624     4.5503 
   H 108    2.2957     2.1611     1.4730     2.3825     2.9671     5.2805 
   H 109    1.7385     1.6179     3.3350     4.3385     4.9691     7.3589 
   H 110    3.0937     3.2037     3.7403     4.1077     4.5503     6.8595 
   H 111    7.5386     7.4732     4.7874     3.7987     3.1408     0.6534 
   H 112    1.8755     1.7578     3.4641     4.4643     5.0912     7.4652 
   H 113    3.0777     3.0112     5.0668     6.0681     6.6941     9.0413 
   H 114    3.0112     3.0777     5.7764     6.7506     7.4086     9.9750 
   H 115    1.7578     1.8755     4.4858     5.4003     6.0462     8.6297 
   H 116    8.2561     8.2175     5.6633     4.6515     4.0204     2.1917 
   H 117    9.0298     8.9879     6.4049     5.3904     4.7479     2.6591 
   H 118    8.6692     8.6972     6.9003     6.1236     5.7590     5.4755 
   H 119    2.0659     2.2063     4.6117     5.4575     6.0828     8.6562 
   H 120    2.5483     2.6981     4.7386     5.4752     6.0613     8.5882 
   H 121    1.9864     2.1321     3.8918     4.6036     5.1857     7.7117 
   H 122   13.7534    13.6851    10.9904    10.0132     9.3569     6.7899 
   H 123    3.1409     3.2350     5.9131     6.8507     7.5012    10.0831 
   H 124    3.1534     3.2756     5.8313     6.7065     7.3389     9.9171 
   H 125    2.2908     2.4183     4.9546     5.8348     6.4702     9.0507 
   H 126   13.0081    12.9550    10.3025     9.2957     8.6371     6.1777 
   H 127   14.8457    14.7899    12.1257    11.1233    10.4639     7.9682 
   H 128   16.4128    16.3511    13.6684    12.6768    12.0175     9.4785 
   H 129   15.0184    14.9375    12.2404    11.3050    10.6632     8.0823 
   H 130    4.2011     4.1764     6.5108     7.5228     8.1624    10.5587 
   H 131    9.2677     9.2005     6.5090     5.5274     4.8708     2.3137 
   H 132   13.4724    13.4047    10.7108     9.7322     9.0755     6.5106 
   H 133    9.3984     9.3965     7.1777     6.2450     5.7229     4.5697 
   H 134   13.2239    13.1767    10.5502     9.5380     8.8828     6.4843 
   H 135   13.9622    13.9199    11.3181    10.3037     9.6526     7.3011 
   H 136   14.4416    14.3920    11.7522    10.7425    10.0853     7.6458 
   H 137    3.9409     3.8236     5.0220     5.9241     6.4710     8.5248 
   H 138    4.3569     4.2591     5.7718     6.7055     7.2727     9.3803 
   H 139    3.6582     3.5768     5.4031     6.3813     6.9849     9.2366 
   H 140   10.3623    10.3179     7.7135     6.6990     6.0492     3.7799 
   H 141    4.6329     4.6972     7.3935     8.3714     9.0298    11.5935 
   H 142    4.4038     4.4922     7.1801     8.1227     8.7738    11.3552 
   H 143    3.5426     3.6263     6.3207     7.2731     7.9269    10.5052 
   H 144   15.6499    15.5632    12.8761    11.9649    11.3334     8.7668 
   H 145   10.9978    10.9294     8.2350     7.2578     6.6019     4.0348 
   H 146   10.0592    10.0821     8.1699     7.3326     6.9031     6.1723 
   H 147   10.8698    10.8878     8.8922     8.0196     7.5533     6.5724 
   H 148   10.5795    10.5861     8.4478     7.5320     7.0235     5.8348 
   H 149   16.3829    16.3308    13.6789    12.6724    12.0138     9.5396 
   H 150   17.3404    17.2769    14.5901    13.6022    12.9434    10.3950 
   H 151   11.5307    11.4879     8.8886     7.8739     7.2244     4.9262 
   H 152   12.2834    12.2460     9.6773     8.6628     8.0196     5.7776 
   H 153   12.7418    12.6957    10.0757     9.0626     8.4086     6.0319 
   H 154   17.3107    17.2316    14.5328    13.5892    12.9436    10.3602 
   H 155   13.8960    13.8229    11.1235    10.1605     9.5084     6.9282 
   H 156   14.1400    14.0591    11.3619    10.4267     9.7854     7.2051 
   H 157   13.3082    13.2249    10.5311     9.6075     8.9715     6.3990 
   H 158   17.1656    17.0726    14.4045    13.5216    12.9027    10.3611 
   H 159   18.7723    18.6867    15.9969    15.0779    14.4420    11.8672 
   H 160   18.7188    18.6209    15.9745    15.1165    14.5091    11.9937 
   H 161   19.9227    19.8355    17.1491    16.2360    15.6023    13.0305 
   H 162   20.7720    20.6861    17.9968    17.0777    16.4413    13.8655 
   H 163   21.0027    20.9119    18.2356    17.3379    16.7109    14.1498 
   H 164   23.5083    23.4040    20.7933    19.9666    19.3730    16.8881 
   H 165   24.1575    24.0601    21.4094    20.5419    19.9282    17.3930 
   H 166   21.7718    21.6858    18.9967    18.0775    17.4409    14.8647 
   H 167   22.9227    22.8354    20.1492    19.2349    18.6002    16.0263 
   H 168   23.7717    23.6855    20.9967    20.0774    19.4404    16.8636 
   H 169   24.0019    23.9114    21.2338    20.3327    19.7036    17.1380 

              H 103      H 104      H 105      H 106      H 107      H 108
              ------------------------------------------------------------------
   H 103    0.0000 
   H 104    0.8768     0.0000 
   H 105    4.3952     4.6144     0.0000 
   H 106    4.2321     3.3943     5.7578     0.0000 
   H 107    4.5347     3.6613     6.5575     0.8768     0.0000 
   H 108    5.3395     4.4744     6.9416     1.2400     0.8768     0.0000 
   H 109    7.4151     6.5458     8.7472     3.2831     2.8919     2.0822 
   H 110    7.4501     6.8570     6.0360     4.3108     4.9591     4.4626 
   H 111    1.2346     1.8414     3.2773     4.7083     5.1948     5.9119 
   H 112    7.5082     6.6372     8.8865     3.3970     2.9783     2.1850 
   H 113    9.0437     8.1682    10.4648     4.9926     4.5125     3.7666 
   H 114   10.2038     9.3714    10.4958     5.9771     5.8746     4.9987 
   H 115    8.9411     8.1442     8.9249     4.7895     4.8789     4.0217 
   H 116    2.8966     3.4311     2.0230     5.7377     6.3759     6.9775 
   H 117    3.2087     3.8765     2.5941     6.4477     7.0474     7.6843 
   H 118    6.3375     6.5435     1.9436     7.2731     8.1227     8.3714 
   H 119    9.0302     8.2647     8.6773     4.9833     5.1843     4.3589 
   H 120    9.0391     8.3207     8.2619     5.1843     5.5189     4.7520 
   H 121    8.1639     7.4506     7.4810     4.3589     4.7520     4.0302 
   H 122    6.6817     7.5571     7.6285    10.8577    11.2158    12.0090 
   H 123   10.3681     9.5564    10.3654     6.1748     6.1664     5.2915 
   H 124   10.2718     9.4924     9.9125     6.1664     6.2815     5.4252 
   H 125    9.3972     8.6160     9.1551     5.2915     5.4252     4.5767 
   H 126    6.2818     7.1449     6.3292    10.2527    10.7224    11.4566 
   H 127    7.9985     8.8721     8.1322    12.0554    12.4922    13.2467 
   H 128    9.4214    10.2980     9.8313    13.5637    13.9506    14.7318 
   H 129    7.8053     8.6537     9.3738    12.0374    12.2884    13.1224 
   H 130   10.5836     9.7091    11.8091     6.4868     6.0492     5.2782 
   H 131    2.3800     3.2349     4.0584     6.4007     6.8244     7.5809 
   H 132    6.4127     7.2888     7.3539    10.5816    10.9458    11.7361 
   H 133    5.3396     5.7810     1.7320     7.4164     8.1853     8.6217 
   H 134    6.6531     7.5040     6.3200    10.5299    11.0344    11.7464 
   H 135    7.5029     8.3469     6.8644    11.3194    11.8464    12.5430 
   H 136    7.7533     8.6174     7.5452    11.7142    12.1928    12.9223 
   H 137    8.3666     7.4981    10.4958     4.7546     4.0417     3.5547 
   H 138    9.2367     8.3667    11.2555     5.5466     4.8708     4.3237 
   H 139    9.1750     8.2985    10.8598     5.2602     4.6864     4.0203 
   H 140    4.1416     4.9203     3.6801     7.7273     8.2859     8.9572 
   H 141   11.8090    10.9702    12.0661     7.5779     7.4278     6.5575 
   H 142   11.6326    10.8157    11.5870     7.4278     7.3796     6.5028 
   H 143   10.7688     9.9479    10.8476     6.5575     6.5028     5.6260 
   H 144    8.4212     9.2475    10.2464    12.6416    12.8413    13.6899 
   H 145    3.9755     4.8516     5.3105     8.1098     8.4946     9.2732 
   H 146    6.9846     7.3406     2.8249     8.5009     9.3277     9.6423 
   H 147    7.3406     7.7796     3.4457     9.1937    10.0017    10.3602 
   H 148    6.5723     7.0591     2.9659     8.7059     9.4852     9.9014 
   H 149    9.5865    10.4593     9.4787    13.6225    14.0724    14.8200 
   H 150   10.3122    11.1878    10.7782    14.4752    14.8457    15.6351 
   H 151    5.2222     6.0319     4.6217     8.9009     9.4508    10.1294 
   H 152    6.0953     6.8991     5.1372     9.7122    10.2836    10.9457 
   H 153    6.2310     7.0738     5.8355    10.0635    10.5797    11.2835 
   H 154   10.1061    10.9572    11.3987    14.3379    14.5934    15.4270 
   H 155    6.7546     7.6241     7.9805    10.9644    11.2848    12.0938 
   H 156    6.9282     7.7784     8.5835    11.1603    11.4170    12.2487 
   H 157    6.0855     6.9282     7.9949    10.3164    10.5572    11.3933 
   H 158    9.9524    10.7500    11.9712    14.1368    14.2776    15.1393 
   H 159   11.5442    12.3737    13.0864    15.7676    15.9663    16.8161 
   H 160   11.5406    12.3130    13.6979    15.6809    15.7735    16.6429 
   H 161   12.6939    13.5173    14.2540    16.9116    17.0948    17.9485 
   H 162   13.5437    14.3717    15.0023    17.7658    17.9577    18.8096 
   H 163   13.7793    14.5884    15.4662    17.9795    18.1304    18.9910 
   H 164   16.3953    17.1378    18.6168    20.4686    20.4974    21.3730 
   H 165   16.9677    17.7485    18.8440    21.1202    21.2107    22.0811 
   H 166   14.5435    15.3708    15.9680    18.7650    18.9540    19.8068 
   H 167   15.6940    16.5165    17.1412    19.9107    20.0870    20.9428 
   H 168   16.5432    17.3695    17.9107    20.7638    20.9479    21.8021 
   H 169   16.7773    17.5880    18.3382    20.9794    21.1283    21.9898 

              H 109      H 110      H 111      H 112      H 113      H 114
              ------------------------------------------------------------------
   H 109    0.0000 
   H 110    4.8191     0.0000 
   H 111    7.9862     7.2418     0.0000 
   H 112    0.1500     4.9608     8.0949     0.0000 
   H 113    1.7320     6.0896     9.6764     1.6039     0.0000 
   H 114    3.2078     4.9608    10.5492     3.2043     2.7000     0.0000 
   H 115    2.7780     3.3827     9.1739     2.8500     3.2043     1.6039 
   H 116    8.9877     7.3147     1.6620     9.1111    10.7143    11.2362 
   H 117    9.7155     8.1059     2.0354     9.8358    11.4368    12.0170 
   H 118    9.9785     6.4284     5.2009    10.1249    11.6435    11.2615 
   H 119    3.3590     2.9056     9.1709     3.4456     3.8904     2.0821 
   H 120    4.0634     2.2901     9.0609     4.1658     4.7445     2.8918 
   H 121    3.6648     1.6779     8.1870     3.7871     4.6452     3.2830 
   H 122   14.0895    13.2170     6.2174    14.1857    15.7253    16.7626 
   H 123    3.6648     4.6314    10.6352     3.6837     3.3590     0.6950 
   H 124    4.0634     4.0130    10.4381     4.1114     4.0634     1.5372 
   H 125    3.3590     3.3952     9.5778     3.4270     3.6648     1.6219 
   H 126   13.5318    12.1536     5.5456    13.6403    15.2190    16.0133 
   H 127   15.3267    14.0023     7.3490    15.4317    17.0002    17.8535 
   H 128   16.8139    15.6704     8.8810    16.9132    18.4627    19.4239 
   H 129   15.1802    14.7529     7.5786    15.2639    16.7501    18.0060 
   H 130    3.2037     6.9507    11.1885     3.0937     1.5505     2.4759 
   H 131    9.6623     8.8858     1.7320     9.7656    11.3318    12.2775 
   H 132   13.8170    12.9317     5.9355    13.9140    15.4563    16.4820 
   H 133   10.4648     7.6533     4.1093    10.6028    12.1865    12.2131 
   H 134   13.8129    12.2369     5.8406    13.9252    15.5128    16.2198 
   H 135   14.6014    12.8521     6.6526    14.7164    16.3091    16.9468 
   H 136   14.9953    13.4763     7.0104    15.1050    16.6862    17.4416 
   H 137    2.2064     7.0254     9.1771     2.0659     1.7152     4.3979 
   H 138    2.6981     7.4443    10.0317     2.5483     1.5556     4.1945 
   H 139    2.1321     6.7127     9.8809     1.9864     0.6870     3.3276 
   H 140   11.0060     9.4188     3.1269    11.1231    12.7198    13.3538 
   H 141    4.6453     6.3607    12.1700     4.6117     3.6648     1.6220 
   H 142    4.7446     5.7415    11.9084     4.7386     4.0634     1.5372 
   H 143    3.8904     5.1225    11.0653     3.8918     3.3590     0.6950 
   H 144   15.7278    15.5145     8.2973    15.8051    17.2603    18.6187 
   H 145   11.3552    10.5581     3.4641    11.4546    13.0071    14.0068 
   H 146   11.3225     7.8515     5.7716    11.4673    13.0048    12.6817 
   H 147   12.0915     8.7178     6.1085    12.2348    13.7863    13.5274 
   H 148   11.7095     8.6332     5.3376    11.8496    13.4233    13.3298 
   H 149   16.8982    15.4309     8.9142    17.0048    18.5775    19.3864 
   H 150   17.7164    16.6199     9.8042    17.8138    19.3559    20.3515 
   H 151   12.1805    10.5060     4.2731    12.2972    13.8931    14.5181 
   H 152   12.9854    11.1204     5.1242    13.1046    14.7041    15.2559 
   H 153   13.3465    11.7451     5.3850    13.4600    15.0501    15.7356 
   H 154   17.4853    16.9560     9.8382    17.5689    19.0529    20.3028 
   H 155   14.1693    13.4687     6.3814    14.2613    15.7843    16.8999 
   H 156   14.3089    13.8926     6.7055    14.3935    15.8850    17.1280 
   H 157   13.4490    13.1447     5.9242    13.5321    15.0177    16.2893 
   H 158   17.1463    17.1609     9.9237    17.2156    18.6276    20.1065 
   H 159   18.8512    18.5555    11.3766    18.9273    20.3737    21.7444 
   H 160   18.6179    18.8227    11.5809    18.6804    20.0514    21.6307 
   H 161   19.9755    19.7294    12.5450    20.0493    21.4827    22.8887 
   H 162   20.8403    20.5357    13.3708    20.9150    22.3527    23.7428 
   H 163   20.9999    20.8891    13.6816    21.0692    22.4774    23.9527 
   H 164   23.2928    23.7341    16.4949    23.3447    24.6457    26.3717 
   H 165   24.0484    24.1862    16.9538    24.1086    25.4618    27.0704 
   H 166   21.8355    21.5271    14.3684    21.9096    23.3434    24.7421 
   H 167   22.9644    22.6999    15.5346    23.0366    24.4594    25.8876 
   H 168   23.8274    23.5123    16.3647    23.9004    25.3273    26.7409 
   H 169   23.9954    23.8502    16.6606    24.0637    25.4642    26.9527 

              H 115      H 116      H 117      H 118      H 119      H 120
              ------------------------------------------------------------------
   H 115    0.0000 
   H 116    9.7521     0.0000 
   H 117   10.5408     0.7971     0.0000 
   H 118    9.6582     3.7849     4.1417     0.0000 
   H 119    0.6870     9.6346    10.4292     9.2881     0.0000 
   H 120    1.5556     9.3758    10.1729     8.7178     0.8768     0.0000 
   H 121    1.7152     8.5303     9.3272     8.0493     1.2400     0.8768 
   H 122   15.3885     5.9250     5.1554     8.6825    15.3643    15.1977 
   H 123    1.4730    11.2246    12.0135    11.0189     1.7320     2.4323 
   H 124    1.4035    10.9052    11.7003    10.4403     1.2732     1.7320 
   H 125    0.5866    10.0815    10.8747     9.7797     0.4920     1.2732 
   H 126   14.5686     4.8588     4.0618     7.1870    14.4798    14.2346 
   H 127   16.4173     6.7138     5.9167     8.8378    16.3336    16.0896 
   H 128   18.0138     8.3640     7.5687    10.5309    17.9525    17.7331 
   H 129   16.7051     7.5613     6.8291    10.5259    16.7375    16.6388 
   H 130    3.6748    12.1740    12.9102    12.8703     4.3206     5.1927 
   H 131   10.9058     2.0354     1.6620     5.7615    10.8972    10.7684 
   H 132   15.1056     5.6413     4.8732     8.4295    15.0799    14.9123 
   H 133   10.6350     2.4644     2.5137     1.9436    10.3654     9.9125 
   H 134   14.7510     5.0024     4.2105     7.0237    14.6360    14.3578 
   H 135   15.4582     5.7107     4.9324     7.3657    15.3193    15.0094 
   H 136   15.9804     6.2368     5.4430     8.1620    15.8714    15.5971 
   H 137    4.6453    10.4168    11.0789    11.8976     5.3060     6.1022 
   H 138    4.7446    11.2446    11.9173    12.5998     5.4278     6.2700 
   H 139    3.8904    10.9976    11.7001    12.1105     4.5761     5.4278 
   H 140   11.8816     2.1356     1.3414     4.8708    11.7700    11.5065 
   H 141    3.1413    12.8514    13.6340    12.7501     3.4641     4.1309 
   H 142    2.7423    12.4878    13.2781    12.1656     2.9109     3.4641 
   H 143    1.9356    11.6837    12.4709    11.5107     2.2241     2.9109 
   H 144   17.3565     8.3935     7.6807    11.4447    17.4161    17.3506 
   H 145   12.6378     3.3947     2.7170     6.7336    12.6252    12.4827 
   H 146   11.0788     4.1664     4.2612     1.4244    10.7123    10.1403 
   H 147   11.9258     4.4548     4.3924     2.2901    11.5699    11.0075 
   H 148   11.7377     3.6758     3.5494     2.3470    11.4261    10.9175 
   H 149   17.9326     8.1940     7.3993     9.9853    17.8284    17.5558 
   H 150   18.9489     9.3122     8.5172    11.4507    18.8932    18.6790 
   H 151   13.0370     3.2849     2.5014     5.5077    12.9119    12.6268 
   H 152   13.7543     4.0288     3.2725     5.7540    13.6028    13.2825 
   H 153   14.2635     4.5133     3.7228     6.5822    14.1459    13.8660 
   H 154   18.9891     9.6910     8.9282    12.3633    19.0077    18.8868 
   H 155   15.5523     6.2146     5.4629     9.1027    15.5500    15.4106 
   H 156   15.8268     6.7344     6.0178     9.8075    15.8608    15.7664 
   H 157   15.0047     6.0827     5.4047     9.3330    15.0529    14.9791 
   H 158   18.8903    10.1006     9.3985    13.1752    18.9791    18.9477 
   H 159   20.4740    11.3354    10.5855    14.0876    20.5227    20.4374 
   H 160   20.4558    11.8151    11.1208    14.9063    20.5692    20.5668 
   H 161   21.6292    12.5098    11.7587    15.2314    21.6843    21.6054 
   H 162   22.4739    13.2909    12.5316    15.9237    22.5214    22.4315 
   H 163   22.7204    13.7001    12.9563    16.4649    22.7932    22.7353 
   H 164   25.2571    16.7472    16.0471    19.7678    25.4021    25.4342 
   H 165   25.8925    17.0514    16.3178    19.8600    25.9979    25.9783 
   H 166   23.4739    14.2733    13.5105    16.8557    23.5207    23.4288 
   H 167   24.6290    15.4484    14.6857    18.0159    24.6815    24.5955 
   H 168   25.4739    16.2446    15.4765    18.7409    25.5197    25.4243 
   H 169   25.7181    16.6220    15.8653    19.2383    25.7863    25.7192 

              H 121      H 122      H 123      H 124      H 125      H 126
              ------------------------------------------------------------------
   H 121    0.0000 
   H 122   14.3332     0.0000 
   H 123    2.9720    16.8518     0.0000 
   H 124    2.4323    16.6355     0.8768     0.0000 
   H 125    1.7320    15.7818     1.2400     0.8768     0.0000 
   H 126   13.3877     1.6485    16.0412    15.7522    14.9195     0.0000 
   H 127   15.2429     1.7046    17.8895    17.6061    16.7720     1.8552 
   H 128   16.8804     2.7581    19.4835    19.2257    18.3838     3.5207 
   H 129   15.7655     1.8840    18.1499    17.9994    17.1327     3.5207 
   H 130    5.3469    17.2650     3.1552     4.0130     3.9475    16.7340 
   H 131    9.8971     4.4861    12.3672    12.1659    11.3073     3.9120 
   H 132   14.0479     0.2856    16.5692    16.3512    15.4978     1.4799 
   H 133    9.1551     6.7396    12.0660    11.5869    10.8475     5.2489 
   H 134   13.5210     2.1098    16.2238    15.9059    15.0838     0.5866 
   H 135   14.1840     2.5875    16.9297    16.5852    15.7741     1.4035 
   H 136   14.7595     2.0177    17.4533    17.1418    16.3176     1.4730 
   H 137    5.8162    14.9819     5.0374     5.6843     5.1725    14.6422 
   H 138    6.1021    15.8579     4.8733     5.6083     5.2181    15.5091 
   H 139    5.3059    15.8438     4.0019     4.7316     4.3511    15.4055 
   H 140   10.6638     3.9485    13.3544    13.0408    12.2160     2.7349 
   H 141    4.7041    18.3821     1.7321     2.4324     2.9721    17.6345 
   H 142    4.1309    18.1250     1.2733     1.7321     2.4324    17.3102 
   H 143    3.4641    17.2827     0.4921     1.2733     1.7321    16.4910 
   H 144   16.4749     2.8320    18.7888    18.6707    17.7997     4.4708 
   H 145   11.6137     2.7557    14.0993    13.8947    13.0375     2.4195 
   H 146    9.4736     8.1007    12.4429    11.8638    11.2039     6.5099 
   H 147   10.3324     7.6827    13.2992    12.7289    12.0611     6.0546 
   H 148   10.1988     6.9026    13.1445    12.6200    11.9139     5.2948 
   H 149   16.7181     3.1678    19.4055    19.0992    18.2735     3.3767 
   H 150   17.8252     3.6309    20.4177    20.1664    19.3227     4.4708 
   H 151   11.7916     3.1827    14.5093    14.1807    13.3622     1.7151 
   H 152   12.4604     3.1978    15.2241    14.8665    14.0607     1.5555 
   H 153   13.0296     2.3354    15.7363    15.4156    14.5944     0.6870 
   H 154   18.0161     3.7762    20.4382    20.2729    19.4091     5.1767 
   H 155   14.5418     0.5241    17.0096    16.8185    15.9591     2.1585 
   H 156   14.8926     1.4006    17.2714    17.1222    16.2551     3.0168 
   H 157   14.1037     1.6407    16.4436    16.3104    15.4409     2.9924 
   H 158   18.0710     4.5340    20.3063    20.2240    19.3496     6.1517 
   H 159   19.5633     5.4587    21.9100    21.7809    20.9116     6.9032 
   H 160   19.6901     6.2526    21.8557    21.8042    20.9281     7.8549 
   H 161   20.7308     6.6255    23.0618    22.9408    22.0705     8.0444 
   H 162   21.5578     7.3817    23.9099    23.7801    22.9110     8.7444 
   H 163   21.8594     7.8400    24.1436    24.0443    23.1716     9.2784 
   H 164   24.5587    11.0854    26.6321    26.6224    25.7456    12.6279 
   H 165   25.1015    11.2244    27.2950    27.2370    26.3613    12.6736 
   H 166   22.5554     8.3567    24.9098    24.7797    23.9107     9.6885 
   H 167   23.7216     9.5318    26.0619    25.9390    25.0692    10.8558 
   H 168   24.5513    10.3212    26.9098    26.7792    25.9104    11.6051 
   H 169   24.8440    10.7175    27.1427    27.0392    26.1671    12.0692 

              H 127      H 128      H 129      H 130      H 131      H 132
              ------------------------------------------------------------------
   H 127    0.0000 
   H 128    1.7046     0.0000 
   H 129    2.8201     2.6791     0.0000 
   H 130   18.5244    19.9985    18.3001     0.0000 
   H 131    5.6685     7.1649     5.8769    12.8573     0.0000 
   H 132    1.8513     3.0151     2.1097    16.9950     4.2048     0.0000 
   H 133    6.9304     8.6307     8.5872    13.5393     4.1737     6.4878 
   H 134    1.8264     3.5308     3.9302    17.0166     4.2731     1.9865 
   H 135    1.6250     3.2165     4.2265    17.8040     5.1242     2.5483 
   H 136    0.7489     2.3746     3.4555    18.1983     5.3850     2.0659 
   H 137   16.3616    17.7388    15.8518     2.9056    10.7305    14.7242 
   H 138   17.2335    18.6146    16.7271     2.2901    11.5971    15.5998 
   H 139   17.1640    18.5924    16.8015     1.6779    11.5011    15.5793 
   H 140    4.5866     6.2526     5.7177    14.2065     1.9436     3.6748 
   H 141   19.4753    21.0457    19.6137     2.6913    13.8977    18.1018 
   H 142   19.1594    20.7556    19.4193     3.3533    13.6404    17.8425 
   H 143   18.3373    19.9245    18.5611     2.9282    12.7968    17.0007 
   H 144    3.6645     3.1678     0.9500    18.8104     6.6293     3.0505 
   H 145    4.0318     5.4587     4.2000    14.5410     1.7321     2.4759 
   H 146    8.0055     9.6613     9.9805    14.2583     5.9201     7.8718 
   H 147    7.4308     9.0510     9.5663    15.0637     6.0096     7.4720 
   H 148    6.7661     8.4215     8.7859    14.7484     5.1484     6.6817 
   H 149    1.5903     1.1331     3.6309    20.0983     7.2481     3.3666 
   H 150    2.6470     0.9501     3.1678    20.8950     8.0821     3.9000 
   H 151    3.5157     5.2107     5.0489    15.3813     2.8995     2.9400 
   H 152    3.0850     4.7836     5.0755    16.1819     3.7759     3.0073 
   H 153    2.2999     4.0036     4.2059    16.5500     3.8536     2.1611 
   H 154    3.7168     2.3789     2.3051    20.6031     8.1193     4.0562 
   H 155    2.0694     2.8261     1.4242    17.3291     4.6528     0.6950 
   H 156    2.8125     3.1705     0.8785    17.4346     5.0104     1.5371 
   H 157    3.3036     3.9502     1.7325    16.5676     4.2626     1.6219 
   H 158    5.1106     4.1423     2.6563    20.1735     8.2903     4.7658 
   H 159    5.4319     3.9728     3.8036    21.9232     9.6801     5.7325 
   H 160    6.6941     5.5031     4.3830    21.5895     9.9756     6.4902 
   H 161    6.5123     4.9681     4.9767    23.0310    10.8520     6.9010 
   H 162    7.1374     5.5242     5.7930    23.9013    11.6690     7.6613 
   H 163    7.7515     6.1946     6.1453    24.0221    12.0042     8.1126 
   H 164   11.2370     9.7561     9.2573    26.1634    14.9059    11.3393 
   H 165   11.1289     9.5352     9.4905    26.9944    15.3049    11.4944 
   H 166    8.0411     6.3939     6.7900    24.8916    12.6647     8.6377 
   H 167    9.1915     7.5300     7.9576    26.0061    13.8339     9.8129 
   H 168    9.9044     8.2229     8.7862    26.8746    14.6581    10.6040 
   H 169   10.4213     8.7655     9.0974    27.0073    14.9718    10.9967 

              H 133      H 134      H 135      H 136      H 137      H 138
              ------------------------------------------------------------------
   H 133    0.0000 
   H 134    5.1078     0.0000 
   H 135    5.5077     0.8768     0.0000 
   H 136    6.2736     1.2399     0.8768     0.0000 
   H 137   12.1691    14.9890    15.8193    16.1150     0.0000 
   H 138   12.9439    15.8514    16.6787    16.9821     0.8769     0.0000 
   H 139   12.5702    15.7207    16.5313    16.8768     1.2400     0.8768 
   H 140    2.9801     2.8694     3.6055     4.1017    12.2942    13.1436 
   H 141   13.7745    17.8386    18.5621    19.0615     5.3476     4.9027 
   H 142   13.2762    17.4886    18.1895    18.7194     5.7780     5.4400 
   H 143   12.5507    16.6802    17.3915    17.9079     5.0676     4.8188 
   H 144    9.5097     4.8757     5.1390     4.3399    16.2904    17.1618 
   H 145    4.8944     2.8996     3.7759     3.8536    12.3316    13.2043 
   H 146    1.7477     6.2473     6.4482     7.2909    13.1888    13.9138 
   H 147    2.0033     5.7314     5.8368     6.6991    13.9138    14.6553 
   H 148    1.3126     5.0147     5.2092     6.0509    13.4535    14.2191 
   H 149    8.1406     3.1980     2.6338     1.9587    17.9509    18.8224 
   H 150    9.5598     4.4701     4.1042     3.2889    18.6019    19.4784 
   H 151    3.5642     1.7320     2.4324     2.9720    13.4496    14.3023 
   H 152    3.8471     1.2732     1.7320     2.4323    14.2942    15.1433 
   H 153    4.6558     0.4921     1.2732     1.7320    14.5472    15.4073 
   H 154   10.4236     5.3989     5.3417     4.4651    18.1380    19.0123 
   H 155    7.1633     2.6328     3.0986     2.4825    14.9888    15.8657 
   H 156    7.8795     3.5064     3.9665     3.3110    15.0046    15.8805 
   H 157    7.4338     3.5505     4.1684     3.6571    14.1288    15.0047 
   H 158   11.2390     6.5171     6.6809     5.8361    17.5691    18.4319 
   H 159   12.1463     7.1309     7.0541     6.1777    19.3723    20.2405 
   H 160   12.9691     8.1960     8.2983     7.4356    18.9201    19.7723 
   H 161   13.2924     8.2490     8.1236     7.2509    20.4525    21.3176 
   H 162   13.9909     8.9128     8.7259     7.8625    21.3277    22.1931 
   H 163   14.5247     9.4882     9.3613     8.4892    21.3985    22.2575 
   H 164   17.8249    12.9015    12.8607    11.9840    23.4039    24.2321 
   H 165   17.9197    12.8794    12.7287    11.8610    24.2887    25.1317 
   H 166   14.9281     9.8352     9.6089     8.7548    22.3083    23.1725 
   H 167   16.0912    10.9931    10.7464     9.8984    23.4009    24.2621 
   H 168   16.8245    11.7184    11.4330    10.5973    24.2745    25.1362 
   H 169   17.3103    12.2176    11.9819    11.1316    24.3646    25.2200 

              H 139      H 140      H 141      H 142      H 143      H 144
              ------------------------------------------------------------------
   H 139    0.0000 
   H 140   12.9608     0.0000 
   H 141    4.1339    14.9717     0.0000 
   H 142    4.6167    14.6193     0.8768     0.0000 
   H 143    3.9636    13.8111     1.2400     0.8768     0.0000 
   H 144   17.2790     6.6127    20.2169    20.0537    19.1895     0.0000 
   H 145   13.1499     1.9436    15.6264    15.3724    14.5285     5.0050 
   H 146   13.4535     4.5987    14.1740    13.5896    12.9347    10.9221 
   H 147   14.2191     4.4676    15.0292    14.4529    13.7907    10.5147 
   H 148   13.8248     3.5923    14.8661    14.3297    13.6333     9.7312 
   H 149   18.7478     6.0585    21.0072    20.6726    19.8583     4.2348 
   H 150   19.4734     7.2025    21.9730    21.6902    20.8567     3.4088 
   H 151   14.1296     1.1752    16.1346    15.7718    14.9686     5.9847 
   H 152   14.9546     2.0000    16.8675    16.4805    15.6891     6.0254 
   H 153   15.2655     2.3825    17.3539    17.0005    16.1934     5.1560 
   H 154   19.0987     7.7195    21.9124    21.7089    20.8530     1.9436 
   H 155   15.8804     4.3107    18.5163    18.2822    17.4334     2.3587 
   H 156   15.9436     4.9591    18.7361    18.5408    17.6826     1.6634 
   H 157   15.0714     4.4626    17.8941    17.7112    16.8503     2.3732 
   H 158   18.6046     8.3441    21.6908    21.5640    20.6943     1.7320 
   H 159   20.3797     9.4068    23.3435    23.1761    22.3130     3.1269 
   H 160   19.9924    10.0759    23.2004    23.1054    22.2323     3.4641 
   H 161   21.4753    10.5740    24.4844    24.3264    23.4617     4.2730 
   H 162   22.3483    11.3240    25.3409    25.1758    24.3125     5.1242 
   H 163   22.4463    11.7873    25.5402    25.4041    24.5360     5.3849 
   H 164   24.5293    14.9742    27.9155    27.8677    26.9916     8.3704 
   H 165   25.3832    15.1680    28.6383    28.5453    27.6723     8.6783 
   H 166   23.3346    12.2923    26.3396    26.1757    25.3122     6.1234 
   H 167   24.4394    13.4664    27.4821    27.3264    26.4616     7.2731 
   H 168   25.3105    14.2424    28.3376    28.1755    27.3119     8.1226 
   H 169   25.4239    14.6601    28.5398    28.4036    27.5357     8.3713 

              H 145      H 146      H 147      H 148      H 149      H 150
              ------------------------------------------------------------------
   H 145    0.0000 
   H 146    6.5409     0.0000 
   H 147    6.3967     0.8769     0.0000 
   H 148    5.5247     1.2400     0.8769     0.0000 
   H 149    5.6220     9.0092     8.3388     7.7789     0.0000 
   H 150    6.3655    10.5506     9.9175     9.3124     1.6712     0.0000 
   H 151    2.1343     4.9437     4.6038     3.7788     4.9298     6.1588 
   H 152    2.8736     4.9844     4.5019     3.7577     4.3433     5.7136 
   H 153    2.5889     5.8544     5.3785     4.6314     3.6900     4.9468 
   H 154    6.4074    11.6458    11.1160    10.4136     3.4861     2.0535 
   H 155    2.9282     8.5636     8.1669     7.3758     3.4043     3.6256 
   H 156    3.3532     9.3364     8.9739     8.1669     3.9535     3.8177 
   H 157    2.6913     8.9740     8.6852     7.8485     4.6251     4.6548 
   H 158    6.7065    12.6345    12.2060    11.4352     5.2754     3.9816 
   H 159    7.9989    13.3779    12.8451    12.1455     5.0050     3.3839 
   H 160    8.4206    14.3518    13.9075    13.1467     6.6127     5.1077 
   H 161    9.1735    14.4944    13.9417    13.2586     5.9261     4.2601 
   H 162    9.9777    15.1418    14.5612    13.9029     6.3994     4.7313 
   H 163   10.3447    15.7340    15.1814    14.4985     7.1271     5.4562 
   H 164   13.3525    19.1344    18.6304    17.9101    10.7293     9.0625 
   H 165   13.6764    19.1228    18.5592    17.8860    10.4047     8.7404 
   H 166   10.9699    16.0445    15.4449    14.8046     7.2043     5.5544 
   H 167   12.1421    17.1892    16.5783    15.9492     8.3000     6.6684 
   H 168   12.9580    17.8812    17.2505    16.6420     8.9333     7.3339 
   H 169   13.2940    18.4224    17.8154    17.1824     9.5399     7.9078 

              H 151      H 152      H 153      H 154      H 155      H 156
              ------------------------------------------------------------------
   H 151    0.0000 
   H 152    0.8768     0.0000 
   H 153    1.2399     0.8768     0.0000 
   H 154    6.8675     6.6634     5.8014     0.0000 
   H 155    3.6267     3.6980     2.8441     3.4873     0.0000 
   H 156    4.3934     4.5379     3.6980     3.1788     0.8768     0.0000 
   H 157    4.0841     4.3934     3.6267     4.0369     1.2399     0.8768 
   H 158    7.7053     7.7062     6.8310     1.9435     4.0796     3.3891 
   H 159    8.5860     8.3953     7.5324     1.7320     5.1226     4.6716 
   H 160    9.4301     9.4056     8.5290     3.1269     5.8072     5.1192 
   H 161    9.7368     9.5186     8.6625     2.8693     6.2963     5.8421 
   H 162   10.4498    10.1859     9.3425     3.6056     7.0782     6.6653 
   H 163   10.9663    10.7573     9.8998     4.1017     7.4945     6.9974 
   H 164   14.2650    14.1524    13.2802     7.5228    10.6735    10.0333 
   H 165   14.3603    14.1497    13.2939     7.4970    10.8646    10.3233 
   H 166   11.3989    11.1080    10.2740     4.5825     8.0641     7.6633 
   H 167   12.5675    12.2650    11.4358     5.7577     9.2386     8.8291 
   H 168   13.3197    12.9869    12.1697     6.5574    10.0444     9.6607 
   H 169   13.7782    13.4903    12.6565     6.9416    10.4076     9.9614 

              H 157      H 158      H 159      H 160      H 161      H 162
              ------------------------------------------------------------------
   H 157    0.0000 
   H 158    4.0327     0.0000 
   H 159    5.4706     1.9436     0.0000 
   H 160    5.7353     1.7321     1.9437     0.0000 
   H 161    6.6316     2.8995     1.1751     2.1343     0.0000 
   H 162    7.4702     3.7759     2.0000     2.8736     0.8769     0.0000 
   H 163    7.7576     3.8536     2.3825     2.5890     1.2400     0.8767 
   H 164   10.6691     6.6487     5.8080     4.9340     4.8032     4.4422 
   H 165   11.0426     7.0323     5.7745     5.4400     4.6315     4.0130 
   H 166    8.4700     4.7431     2.9999     3.6739     1.8608     0.9999 
   H 167    9.6287     5.8349     4.1592     4.6037     3.0001     2.1650 
   H 168   10.4699     6.7066     5.0000     5.4753     3.8537     3.0000 
   H 169   10.7404     6.8507     5.2951     5.4575     4.1208     3.3362 

              H 163      H 164      H 165      H 166      H 167      H 168
              ------------------------------------------------------------------
   H 163    0.0000 
   H 164    3.6260     0.0000 
   H 165    3.3953     1.6200     0.0000 
   H 166    1.1467     3.9666     3.2380     0.0000 
   H 167    2.0235     3.4625     2.3470     1.1752     0.0000 
   H 168    2.8995     3.7059     2.2901     2.0001     0.8768     0.0000 
   H 169    3.0000     2.9170     1.4245     2.3826     1.2400     0.8769 

              H 169
              -----------
   H 169    0.0000 



ATOMIC CHARGES
   O   1   -0.3377358676
   O   2   -0.3420680045
   O   3   -0.3838379424
   O   4   -0.3619476724
   O   5   -0.3430598803
   O   6   -0.3402149131
   O   7   -0.3743778661
   O   8   -0.3840953218
   O   9   -0.3430516955
   O  10   -0.2753119437
   O  11   -0.3720931660
   O  12   -0.3745651224
   O  13   -0.3863851904
   O  14   -0.3636868677
   O  15   -0.3865507166
   O  16   -0.3862448031
   O  17   -0.3751434059
   O  18   -0.2866905748
   O  19   -0.4929254976
   O  20   -0.2869208890
   N  21   -0.3113786797
   N  22   -0.3212743596
   C  23    0.0239050092
   C  24    0.1003945835
   C  25    0.1361163005
   C  26    0.2080021120
   C  27    0.0880082943
   C  28    0.0915655110
   C  29   -0.0546813442
   C  30   -0.0546813442
   C  31    0.1882427934
   C  32    0.1343751102
   C  33   -0.0549427967
   C  34   -0.0396870840
   C  35    0.1174029482
   C  36    0.1162382614
   C  37    0.0876795738
   C  38    0.2215908592
   C  39   -0.0644119619
   C  40   -0.0635585178
   C  41   -0.0360498994
   C  42    0.1885672071
   C  43    0.1371890438
   C  44    0.1144643538
   C  45    0.1125533995
   C  46    0.0875524027
   C  47    0.0302117990
   C  48   -0.0661647042
   C  49    0.0370299456
   C  50    0.0930907256
   C  51   -0.0360516281
   C  52    0.0150938693
   C  53    0.1101520066
   C  54    0.1130555643
   C  55    0.1058945318
   C  56   -0.0670571363
   C  57    0.0843598618
   C  58   -0.0871149015
   C  59   -0.0572921637
   C  60    0.0371362056
   C  61   -0.0439746421
   C  62   -0.0641902133
   C  63    0.0370266865
   C  64   -0.0530785824
   C  65   -0.0465268738
   C  66   -0.0605884724
   C  67   -0.0410608378
   C  68   -0.0631904741
   C  69    0.0372304409
   C  70   -0.0619632537
   C  71   -0.0614038367
   C  72   -0.0551906755
   C  73   -0.0029004893
   C  74   -0.0360601096
   C  75    0.1976880279
   C  76    0.1279013298
   C  77    0.2073796109
   C  78    0.1961947783
   C  79    0.0021788944
   C  80    0.0111210748
   C  81    0.0145727131
   H  82    0.0630872613
   H  83    0.0673671587
   H  84    0.0647653252
   H  85    0.0447916785
   H  86    0.0236703087
   H  87    0.0236703087
   H  88    0.0236703087
   H  89    0.0236703087
   H  90    0.0236703087
   H  91    0.0236703087
   H  92    0.0937498912
   H  93    0.0671036773
   H  94    0.0597712784
   H  95    0.0271554348
   H  96    0.0271554348
   H  97    0.0650271501
   H  98    0.0649709671
   H  99    0.0620845778
   H 100    0.2101235240
   H 101    0.2128580297
   H 102    0.0229992014
   H 103    0.0229992014
   H 104    0.0229992014
   H 105    0.0615185964
   H 106    0.0255359577
   H 107    0.0255359577
   H 108    0.0255359577
   H 109    0.0937595495
   H 110    0.2101106075
   H 111    0.1490067665
   H 112    0.0673577023
   H 113    0.0647734165
   H 114    0.0648443404
   H 115    0.0620829122
   H 116    0.0505751261
   H 117    0.0505751261
   H 118    0.0614309242
   H 119    0.0523642478
   H 120    0.0523642478
   H 121    0.0523642478
   H 122    0.0626429452
   H 123    0.0255359510
   H 124    0.0255359510
   H 125    0.0255359510
   H 126    0.0352265570
   H 127    0.0646119814
   H 128    0.0649226345
   H 129    0.0667327893
   H 130    0.2100052968
   H 131    0.0587524834
   H 132    0.0646283416
   H 133    0.0569270645
   H 134    0.0234125497
   H 135    0.0234125497
   H 136    0.0234125497
   H 137    0.0523656589
   H 138    0.0523656589
   H 139    0.0523656589
   H 140    0.0614966422
   H 141    0.0523642346
   H 142    0.0523642346
   H 143    0.0523642346
   H 144    0.0598364769
   H 145    0.0617799547
   H 146    0.0271795662
   H 147    0.0271795662
   H 148    0.0271795662
   H 149    0.2100025367
   H 150    0.2100161525
   H 151    0.0275259989
   H 152    0.0275259989
   H 153    0.0275259989
   H 154    0.0615287966
   H 155    0.0523752024
   H 156    0.0523752024
   H 157    0.0523752024
   H 158    0.0617499806
   H 159    0.0617676323
   H 160    0.0621354668
   H 161    0.0278693993
   H 162    0.0278693993
   H 163    0.0278693993
   H 164    0.0670467606
   H 165    0.0810922341
   H 166    0.2937001143
   H 167    0.0456538128
   H 168    0.0456538128
   H 169    0.0456538128


BOND ANGLES
  26    1   27   C3   O3   C3    120.001
  24    2   31   C3   O3   C3    120.001
  25    3  100   C3   O3   HO    119.998
  26    4  101   C3   O3   HO    120.001
  31    5   37   C3   O3   C3    120.001
  36    6   42   C3   O3   C3    120.001
  35    7   49   C3   O3   C3    119.998
  32    8  110   C3   O3   HO    120.002
  42    9   46   C3   O3   C3    120.001
  43   11   60   C3   O3   C3    120.001
  45   12   63   C3   O3   C3    119.998
  44   13  130   C3   O3   HO    120.000
  50   14   55   C3   O3   C3    108.001
  53   15  149   C3   O3   HO    120.002
  54   16  150   C3   O3   HO    120.000
  57   17   69   C3   O3   C3    120.001
  77   19  166  Car   O3   HO    120.000
  38   21   47   C2  Nam   C3    119.998
  38   21  111   C2  Nam   HC    120.000
  47   21  111   C3  Nam   HC    120.002
  77   22   80  Car  Nar  Car    120.003
  77   22   81  Car  Nar   C3    120.002
  80   22   81  Car  Nar   C3    119.995
  24   23   27   C3   C3   C3    119.999
  24   23   29   C3   C3   C3     90.000
  24   23   30   C3   C3   C3    150.001
  27   23   29   C3   C3   C3    150.001
  27   23   30   C3   C3   C3     90.000
  29   23   30   C3   C3   C3     60.001
   2   24   23   O3   C3   C3    120.001
   2   24   25   O3   C3   C3    119.998
   2   24   82   O3   C3   HC     59.995
  23   24   25   C3   C3   C3    120.001
  23   24   82   C3   C3   HC    179.974
  25   24   82   C3   C3   HC     60.003
   3   25   24   O3   C3   C3    119.998
   3   25   26   O3   C3   C3    120.001
   3   25   83   O3   C3   HC     59.995
  24   25   26   C3   C3   C3    120.001
  24   25   83   C3   C3   HC     60.003
  26   25   83   C3   C3   HC    179.974
   1   26    4   O3   C3   O3    150.001
   1   26   25   O3   C3   C3    119.999
   1   26   28   O3   C3   C3     90.000
   4   26   25   O3   C3   C3     90.000
   4   26   28   O3   C3   C3     60.001
  25   26   28   C3   C3   C3    150.001
   1   27   23   O3   C3   C3    120.001
   1   27   33   O3   C3   C2    120.001
   1   27   84   O3   C3   HC     59.999
  23   27   33   C3   C3   C2    119.999
  23   27   84   C3   C3   HC    179.974
  33   27   84   C2   C3   HC     60.001
  26   28   34   C3   C3   C3    120.001
  26   28   38   C3   C3   C2    120.001
  26   28   85   C3   C3   HC     59.999
  34   28   38   C3   C3   C2    119.998
  34   28   85   C3   C3   HC     60.002
  38   28   85   C2   C3   HC    179.974
  23   29   86   C3   C3   HC     89.999
  23   29   87   C3   C3   HC    179.974
  23   29   88   C3   C3   HC     90.001
  86   29   87   HC   C3   HC     90.000
  86   29   88   HC   C3   HC    179.974
  87   29   88   HC   C3   HC     90.000
  23   30   89   C3   C3   HC     90.001
  23   30   90   C3   C3   HC    179.974
  23   30   91   C3   C3   HC     89.999
  89   30   90   HC   C3   HC     90.000
  89   30   91   HC   C3   HC    179.974
  90   30   91   HC   C3   HC     90.000
   2   31    5   O3   C3   O3    120.001
   2   31   32   O3   C3   C3    119.999
   2   31   92   O3   C3   HC     59.999
   5   31   32   O3   C3   C3    120.001
   5   31   92   O3   C3   HC    179.974
  32   31   92   C3   C3   HC     59.999
   8   32   31   O3   C3   C3    120.001
   8   32   35   O3   C3   C3    120.001
   8   32   93   O3   C3   HC     59.999
  31   32   35   C3   C3   C3    119.999
  31   32   93   C3   C3   HC     60.001
  35   32   93   C3   C3   HC    179.974
  27   33   40   C3   C2   C2    120.001
  27   33   94   C3   C2   HC    120.001
  40   33   94   C2   C2   HC    119.998
  28   34   39   C3   C3   C3    120.001
  28   34   95   C3   C3   HC    159.993
  28   34   96   C3   C3   HC     79.996
  39   34   95   C3   C3   HC     80.006
  39   34   96   C3   C3   HC    160.003
  95   34   96   HC   C3   HC     79.997
   7   35   32   O3   C3   C3    120.001
   7   35   36   O3   C3   C3    119.998
   7   35   97   O3   C3   HC     59.995
  32   35   36   C3   C3   C3    120.001
  32   35   97   C3   C3   HC    179.974
  36   35   97   C3   C3   HC     60.003
   6   36   35   O3   C3   C3    119.998
   6   36   37   O3   C3   C3    120.001
   6   36   98   O3   C3   HC     59.995
  35   36   37   C3   C3   C3    120.001
  35   36   98   C3   C3   HC     60.003
  37   36   98   C3   C3   HC    179.974
   5   37   36   O3   C3   C3    119.999
   5   37   41   O3   C3   C3    120.001
   5   37   99   O3   C3   HC     60.001
  36   37   41   C3   C3   C3    120.001
  36   37   99   C3   C3   HC    179.974
  41   37   99   C3   C3   HC     59.999
  10   38   21   O2   C2  Nam    120.001
  10   38   28   O2   C2   C3    120.001
  21   38   28  Nam   C2   C3    119.998
  34   39  102   C3   C3   HC     89.999
  34   39  103   C3   C3   HC    179.974
  34   39  104   C3   C3   HC     90.001
 102   39  103   HC   C3   HC     90.000
 102   39  104   HC   C3   HC    179.974
 103   39  104   HC   C3   HC     90.000
  33   40   48   C2   C2   C2    120.001
  33   40  105   C2   C2   HC    119.998
  48   40  105   C2   C2   HC    120.001
  37   41  106   C3   C3   HC     90.000
  37   41  107   C3   C3   HC    179.974
  37   41  108   C3   C3   HC     90.000
 106   41  107   HC   C3   HC     90.000
 106   41  108   HC   C3   HC    179.974
 107   41  108   HC   C3   HC     90.000
   6   42    9   O3   C3   O3    120.001
   6   42   43   O3   C3   C3    119.999
   6   42  109   O3   C3   HC     59.999
   9   42   43   O3   C3   C3    120.001
   9   42  109   O3   C3   HC    179.974
  43   42  109   C3   C3   HC     59.999
  11   43   42   O3   C3   C3    120.001
  11   43   44   O3   C3   C3    120.001
  11   43  112   O3   C3   HC     59.999
  42   43   44   C3   C3   C3    119.999
  42   43  112   C3   C3   HC     60.001
  44   43  112   C3   C3   HC    179.974
  13   44   43   O3   C3   C3    120.001
  13   44   45   O3   C3   C3    119.998
  13   44  113   O3   C3   HC     60.002
  43   44   45   C3   C3   C3    120.001
  43   44  113   C3   C3   HC     59.999
  45   44  113   C3   C3   HC    179.974
  12   45   44   O3   C3   C3    119.998
  12   45   46   O3   C3   C3    120.001
  12   45  114   O3   C3   HC     60.002
  44   45   46   C3   C3   C3    120.001
  44   45  114   C3   C3   HC    179.974
  46   45  114   C3   C3   HC     59.999
   9   46   45   O3   C3   C3    119.999
   9   46   51   O3   C3   C3    120.001
   9   46  115   O3   C3   HC     60.001
  45   46   51   C3   C3   C3    120.001
  45   46  115   C3   C3   HC    179.974
  51   46  115   C3   C3   HC     59.999
  21   47   56  Nam   C3   C2    120.001
  21   47  116  Nam   C3   HC     79.997
  21   47  117  Nam   C3   HC    159.996
  56   47  116   C2   C3   HC    160.002
  56   47  117   C2   C3   HC     80.004
 116   47  117   HC   C3   HC     79.999
  40   48   58   C2   C2   C2    119.999
  40   48  118   C2   C2   HC    120.001
  58   48  118   C2   C2   HC    120.001
   7   49  119   O3   C3   HC     90.000
   7   49  120   O3   C3   HC    179.974
   7   49  121   O3   C3   HC     90.000
 119   49  120   HC   C3   HC     90.000
 119   49  121   HC   C3   HC    179.974
 120   49  121   HC   C3   HC     90.000
  14   50   52   O3   C3   C3    126.003
  14   50   53   O3   C3   C3    108.001
  14   50  122   O3   C3   HC     63.000
  52   50   53   C3   C3   C3    125.996
  52   50  122   C3   C3   HC     63.003
  53   50  122   C3   C3   HC    171.000
  46   51  123   C3   C3   HC     90.000
  46   51  124   C3   C3   HC    179.974
  46   51  125   C3   C3   HC     90.000
 123   51  124   HC   C3   HC     90.000
 123   51  125   HC   C3   HC    179.974
 124   51  125   HC   C3   HC     90.000
  50   52   57   C3   C3   C3    119.998
  50   52   59   C3   C3   C3    120.001
  50   52  126   C3   C3   HC    179.974
  57   52   59   C3   C3   C3    120.001
  57   52  126   C3   C3   HC     59.999
  59   52  126   C3   C3   HC     60.001
  15   53   50   O3   C3   C3    126.002
  15   53   54   O3   C3   C3    126.000
  15   53  127   O3   C3   HC     63.001
  50   53   54   C3   C3   C3    107.998
  50   53  127   C3   C3   HC     63.001
  54   53  127   C3   C3   HC    171.000
  16   54   53   O3   C3   C3    126.002
  16   54   55   O3   C3   C3    125.997
  16   54  128   O3   C3   HC     63.000
  53   54   55   C3   C3   C3    108.001
  53   54  128   C3   C3   HC     63.002
  55   54  128   C3   C3   HC    171.003
  14   55   54   O3   C3   C3    107.999
  14   55   64   O3   C3   C2    126.003
  14   55  129   O3   C3   HC     63.007
  54   55   64   C3   C3   C2    125.999
  54   55  129   C3   C3   HC    171.006
  64   55  129   C2   C3   HC     62.996
  47   56   62   C3   C2   C2    120.001
  47   56  131   C3   C2   HC    119.998
  62   56  131   C2   C2   HC    120.002
  17   57   52   O3   C3   C3    119.998
  17   57   61   O3   C3   C2    120.001
  17   57  132   O3   C3   HC     59.995
  52   57   61   C3   C3   C2    120.001
  52   57  132   C3   C3   HC     60.003
  61   57  132   C2   C3   HC    179.974
  48   58   65   C2   C2   C3    119.999
  48   58  133   C2   C2   HC    120.001
  65   58  133   C3   C2   HC    120.001
  52   59  134   C3   C3   HC     90.001
  52   59  135   C3   C3   HC    179.974
  52   59  136   C3   C3   HC     89.999
 134   59  135   HC   C3   HC     90.000
 134   59  136   HC   C3   HC    179.974
 135   59  136   HC   C3   HC     90.000
  11   60  137   O3   C3   HC     90.004
  11   60  138   O3   C3   HC    179.974
  11   60  139   O3   C3   HC     90.001
 137   60  138   HC   C3   HC     90.000
 137   60  139   HC   C3   HC    179.974
 138   60  139   HC   C3   HC     89.995
  57   61   66   C3   C2   C2    120.001
  57   61   67   C3   C2   C3    119.999
  66   61   67   C2   C2   C3    120.001
  56   62   66   C2   C2   C2    120.001
  56   62  140   C2   C2   HC    120.002
  66   62  140   C2   C2   HC    119.998
  12   63  141   O3   C3   HC     90.000
  12   63  142   O3   C3   HC    179.974
  12   63  143   O3   C3   HC     90.000
 141   63  142   HC   C3   HC     90.000
 141   63  143   HC   C3   HC    179.974
 142   63  143   HC   C3   HC     90.000
  55   64   68   C3   C2   C2    120.003
  55   64  144   C3   C2   HC    120.000
  68   64  144   C2   C2   HC    119.997
  58   65  146   C2   C3   HC     89.999
  58   65  147   C2   C3   HC    179.974
  58   65  148   C2   C3   HC     89.996
 146   65  147   HC   C3   HC     90.005
 146   65  148   HC   C3   HC    179.974
 147   65  148   HC   C3   HC     90.000
  61   66   62   C2   C2   C2    120.001
  61   66  145   C2   C2   HC    119.997
  62   66  145   C2   C2   HC    120.002
  61   67  151   C2   C3   HC     90.001
  61   67  152   C2   C3   HC    179.974
  61   67  153   C2   C3   HC     89.999
 151   67  152   HC   C3   HC     90.000
 151   67  153   HC   C3   HC    179.974
 152   67  153   HC   C3   HC     90.000
  64   68   70   C2   C2   C2    120.003
  64   68  154   C2   C2   HC    119.997
  70   68  154   C2   C2   HC    120.000
  17   69  155   O3   C3   HC     89.999
  17   69  156   O3   C3   HC    179.974
  17   69  157   O3   C3   HC     90.001
 155   69  156   HC   C3   HC     90.000
 155   69  157   HC   C3   HC    179.974
 156   69  157   HC   C3   HC     90.000
  68   70   71   C2   C2   C2    120.003
  68   70  158   C2   C2   HC    119.992
  71   70  158   C2   C2   HC    120.005
  70   71   72   C2   C2   C2    119.997
  70   71  159   C2   C2   HC    119.997
  72   71  159   C2   C2   HC    120.006
  71   72   73   C2   C2   C2    119.994
  71   72  160   C2   C2   HC    120.006
  73   72  160   C2   C2   HC    120.000
  72   73   74   C2   C2   C3    119.998
  72   73   75   C2   C2   C2    119.994
  74   73   75   C3   C2   C2    120.009
  73   74  161   C2   C3   HC     90.002
  73   74  162   C2   C3   HC    179.974
  73   74  163   C2   C3   HC     89.998
 161   74  162   HC   C3   HC     90.008
 161   74  163   HC   C3   HC    179.974
 162   74  163   HC   C3   HC     89.992
  18   75   73   O2   C2   C2    120.003
  18   75   76   O2   C2  Car    120.003
  73   75   76   C2   C2  Car    119.994
  75   76   77   C2  Car  Car    119.998
  75   76   78   C2  Car  Car    119.994
  77   76   78  Car  Car  Car    120.009
  19   77   22   O3  Car  Nar    120.003
  19   77   76   O3  Car  Car    120.003
  22   77   76  Nar  Car  Car    119.994
  20   78   76   O2  Car  Car    120.003
  20   78   79   O2  Car  Car    120.000
  76   78   79  Car  Car  Car    119.997
  78   79   80  Car  Car  Car    119.997
  78   79  164  Car  Car   HC    120.002
  80   79  164  Car  Car   HC    120.001
  22   80   79  Nar  Car  Car    120.001
  22   80  165  Nar  Car   HC    120.006
  79   80  165  Car  Car   HC    119.993
  22   81  167  Nar   C3   HC     89.995
  22   81  168  Nar   C3   HC    179.974
  22   81  169  Nar   C3   HC     89.997
 167   81  168   HC   C3   HC     90.000
 167   81  169   HC   C3   HC    179.974
 168   81  169   HC   C3   HC     90.008


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


CHIRAL ATOMS
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026
 164   79   80  165      0.026