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tris(4-tert-butylphenyl) phosphate
tris(4-tert-butylphenyl) phosphate ID: AN-23944
CAS:78-33-1
Supplier:AN PharmaTech Co Ltd

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SMILES:P(=O)(Oc1ccc(C(C)(C)C)cc1)(Oc1ccc(C(C)(C)C)cc1)Oc1ccc(C(C)(C)C)cc1	6530
FORMULA: C30H39O4P
MASS: 494.6020
EXACT MASS: 494.2585964
INTERATOMIC DISTANCES

              P   1      O   2      O   3      O   4      O   5      C   6
              ------------------------------------------------------------------
   P   1    0.0000 
   O   2    1.0000     0.0000 
   O   3    1.0000     2.0000     0.0000 
   O   4    1.0000     1.4142     1.4142     0.0000 
   O   5    1.0000     1.4142     1.4142     2.0000     0.0000 
   C   6    4.5826     4.0000     5.2915     5.3785     3.8823     0.0000 
   C   7    4.5826     5.2915     4.0000     3.8823     5.3785     9.1651 
   C   8    4.5826     3.8823     5.3785     4.0000     5.2915     6.4807 
   C   9    3.6055     3.0000     4.3589     4.3813     2.9671     1.0000 
   C  10    3.6055     4.3589     3.0000     2.9671     4.3813     8.1853 
   C  11    3.6055     2.9671     4.3813     3.0000     4.3589     5.9776 
   C  12    5.5678     4.8311     6.3765     5.0000     6.2450     7.0900 
   C  13    4.8715     4.3363     5.5371     4.1231     5.6977     7.3302 
   C  14    4.5020     3.6524     5.4033     4.1231     5.0533     5.6805 
   C  15    5.5678     6.2450     5.0000     4.8311     6.3765    10.1489 
   C  16    4.8715     5.6977     4.1231     4.3363     5.5371     9.4055 
   C  17    4.5020     5.0533     4.1231     3.6524     5.4033     9.0297 
   C  18    5.5678     5.0000     6.2450     6.3765     4.8311     1.0000 
   C  19    4.8715     4.1231     5.6977     5.5371     4.3363     1.0000 
   C  20    4.5020     4.1231     5.0533     5.4033     3.6524     1.0000 
   C  21    3.0000     2.6457     3.6055     3.8982     2.1918     1.7320 
   C  22    3.0000     3.6055     2.6457     2.1918     3.8982     7.5498 
   C  23    3.0000     2.1918     3.8982     2.6457     3.6055     4.9804 
   C  24    3.4641     2.6458     4.3589     4.0576     3.0881     1.7321 
   C  25    3.4641     4.3589     2.6457     3.0880     4.0576     7.9372 
   C  26    3.4641     3.0880     4.0576     2.6457     4.3589     6.5872 
   C  27    1.7320     1.5060     2.3941     1.0000     2.6457     5.4033 
   C  28    1.7320     2.6457     1.0000     1.5060     2.3941     6.2450 
   C  29    1.7320     1.0000     2.6457     2.3941     1.5060     3.0000 
   C  30    2.0000     1.2393     2.9093     1.7320     2.6457     4.6407 
   C  31    2.0000     2.6457     1.7320     1.2393     2.9093     6.5574 
   C  32    2.0000     1.7320     2.6457     2.9093     1.2393     2.6457 
   C  33    2.6457     2.5036     3.1196     1.7320     3.6055     6.3343 
   C  34    2.6457     3.6055     1.7320     2.5036     3.1196     7.0000 
   C  35    2.6458     1.7321     3.6056     3.1196     2.5036     2.6458 
   H  36    5.1218     4.7270     5.6675     6.0195     4.2697     1.1766 
   H  37    4.5627     4.3156     5.0013     5.5106     3.6429     1.6200 
   H  38    5.6972     5.0416     6.4419     5.0383     6.4445     7.5701 
   H  39    6.1810     5.4287     6.9956     5.6200     6.8428     7.5099 
   H  40    5.5055     4.6937     6.3711     5.0383     6.1022     6.6331 
   H  41    4.3054     3.8317     4.9387     3.5248     5.1622     7.0434 
   H  42    5.1410     4.7034     5.7217     4.3156     6.0196     7.8747 
   H  43    5.4494     4.8677     6.1399     4.7270     6.2489     7.6565 
   H  44    5.1218     4.2697     6.0195     4.7270     5.6675     6.0958 
   H  45    4.5627     3.6429     5.5106     4.3156     5.0013     5.2190 
   H  46    3.8823     3.0361     4.7882     3.5248     4.4407     5.3053 
   H  47    5.6972     6.4445     5.0383     5.0416     6.4419    10.2729 
   H  48    6.1810     6.8428     5.6200     5.4287     6.9956    10.7603 
   H  49    5.5055     6.1022     5.0383     4.6937     6.3711    10.0616 
   H  50    3.8823     3.5248     4.4407     4.7882     3.0361     1.1766 
   H  51    4.3054     3.5248     5.1622     4.9387     3.8317     1.1766 
   H  52    5.1410     4.3156     6.0196     5.7217     4.7034     1.6200 
   H  53    5.4494     4.7270     6.2489     6.1399     4.8677     1.1766 
   H  54    5.6972     5.0383     6.4445     6.4419     5.0416     1.1766 
   H  55    6.1810     5.6200     6.8428     6.9956     5.4287     1.6200 
   H  56    5.5055     5.0383     6.1022     6.3711     4.6937     1.1766 
   H  57    5.1218     5.6675     4.7270     4.2697     6.0195     9.6478 
   H  58    4.5627     5.0013     4.3156     3.6429     5.5106     9.0007 
   H  59    3.8823     4.4407     3.5248     3.0361     4.7882     8.4119 
   H  60    4.3054     5.1622     3.5248     3.8317     4.9387     8.8141 
   H  61    5.1410     6.0196     4.3156     4.7034     5.7217     9.6040 
   H  62    5.4494     6.2489     4.7270     4.8677     6.1399    10.0004 
   H  63    3.3533     3.1407     3.8242     4.3028     2.4443     1.8396 
   H  64    3.3533     3.8242     3.1408     2.4443     4.3028     7.8169 
   H  65    3.3533     2.4443     4.3028     3.1407     3.8242     4.6561 
   H  66    4.0130     3.1408     4.9340     4.5352     3.6933     1.8397 
   H  67    4.0130     4.9340     3.1408     3.6933     4.5352     8.4157 
   H  68    4.0130     3.6933     4.5352     3.1408     4.9340     7.1967 
   H  69    1.7732     0.8248     2.7583     1.8396     2.2146     4.0479 
   H  70    1.7733     2.2146     1.8397     0.8248     2.7584     6.1987 
   H  71    1.7732     1.8396     2.2146     2.7583     0.8248     3.1407 
   H  72    2.8292     2.8890     3.1085     1.8397     3.8242     6.8190 
   H  73    2.8292     3.8242     1.8397     2.8890     3.1085     6.9386 
   H  74    2.8292     1.8397     3.8242     3.1085     2.8890     3.1408 

              C   7      C   8      C   9      C  10      C  11      C  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    6.4807     0.0000 
   C   9    8.1853     5.6805     0.0000 
   C  10    1.0000     5.9776     7.2111     0.0000 
   C  11    5.6805     1.0000     5.0990     5.0990     0.0000 
   C  12    7.3302     1.0000     6.3668     6.8894     2.0000     0.0000 
   C  13    5.9776     1.0000     6.4807     5.6093     1.4142     1.4142 
   C  14    7.0900     1.0000     4.9534     6.4807     1.4142     1.4142 
   C  15    1.0000     7.0900     9.1651     2.0000     6.3668     7.8740 
   C  16    1.0000     7.3302     8.4536     1.4142     6.4807     8.2136 
   C  17    1.0000     5.6805     8.0334     1.4142     4.9534     6.4807 
   C  18   10.1489     7.3302     2.0000     9.1651     6.8894     7.8740 
   C  19    9.4055     5.9776     1.4142     8.4536     5.6093     6.4807 
   C  20    9.0297     7.0900     1.4142     8.0334     6.4807     7.7805 
   C  21    7.5498     5.9326     1.0000     6.5574     5.2150     6.7228 
   C  22    1.7320     4.9804     6.5574     1.0000     4.0993     5.8995 
   C  23    5.9326     1.7320     4.0993     5.2150     1.0000     2.6457 
   C  24    7.9373     4.7547     1.0001     7.0000     4.2511     5.3984 
   C  25    1.7320     6.5872     7.0000     1.0000     5.6505     7.5403 
   C  26    4.7548     1.7320     5.6505     4.2511     1.0000     2.6457 
   C  27    4.3363     3.0000     4.4118     3.5406     2.0000     4.0000 
   C  28    3.0000     5.4033     5.2915     2.0000     4.4118     6.3975 
   C  29    6.2450     4.3363     2.0000     5.2915     3.5406     5.2031 
   C  30    5.3352     2.6457     3.6791     4.5237     1.7320     3.6055 
   C  31    2.6457     4.6407     5.5678     1.7320     3.6791     5.6157 
   C  32    6.5574     5.3352     1.7320     5.5678     4.5237     6.2019 
   C  33    3.9844     2.6457     5.3535     3.3675     1.7320     3.6055 
   C  34    2.6457     6.3343     6.0827     1.7320     5.3535     7.3204 
   C  35    7.0000     3.9844     1.7321     6.0828     3.3674     4.7340 
   H  36    9.6478     7.5701     1.9038     8.6510     7.0027     8.2203 
   H  37    9.0007     7.5099     1.9038     8.0008     6.8477     8.2405 
   H  38    7.0434     1.1766     6.8069     6.6770     2.0939     0.6200 
   H  39    7.8747     1.6200     6.8313     7.4661     2.6200     0.6200 
   H  40    7.6565     1.1766     5.9587     7.1494     2.0939     0.6200 
   H  41    5.4279     1.1766     6.1545     5.0194     1.0698     1.9038 
   H  42    5.7315     1.6200     7.0027     5.4610     1.9038     1.9038 
   H  43    6.5399     1.1766     6.8477     6.2050     1.9038     1.0698 
   H  44    7.5701     1.1766     5.4246     7.0027     1.9038     1.0698 
   H  45    7.5099     1.6200     4.5548     6.8477     1.9038     1.9038 
   H  46    6.6331     1.1766     4.5182     5.9775     1.0698     1.9038 
   H  47    1.1766     7.5701     9.3023     2.0939     6.8069     8.3832 
   H  48    1.6200     7.5099     9.7747     2.6200     6.8313     8.2541 
   H  49    1.1766     6.6331     9.0684     2.0939     5.9587     7.3818 
   H  50    8.4119     6.6331     1.0698     7.4162     5.9775     7.3666 
   H  51    8.8141     5.4279     1.0698     7.8694     5.0194     5.9775 
   H  52    9.6040     5.7315     1.9038     8.6739     5.4610     6.1545 
   H  53   10.0004     6.5399     1.9038     9.0426     6.2050     7.0027 
   H  54   10.2729     7.0434     2.0939     9.3023     6.6770     7.5258 
   H  55   10.7603     7.8747     2.6200     9.7747     7.4661     8.3832 
   H  56   10.0616     7.6565     2.0939     9.0684     7.1494     8.2541 
   H  57    1.1766     6.0958     8.6510     1.9038     5.4246     6.8477 
   H  58    1.6200     5.2190     8.0008     1.9038     4.5548     5.9775 
   H  59    1.1766     5.3053     7.4162     1.0698     4.5182     6.1545 
   H  60    1.1766     7.0434     7.8694     1.0698     6.1545     7.9588 
   H  61    1.6200     7.8747     8.6739     1.9038     7.0027     8.7739 
   H  62    1.1766     7.6565     9.0426     1.9038     6.8477     8.5061 
   H  63    7.8169     6.5429     1.4157     6.8179     5.8082     7.3405 
   H  64    1.8397     4.6560     6.8179     1.4158     3.8409     5.5321 
   H  65    6.5429     1.8396     3.8410     5.8082     1.4157     2.6008 
   H  66    8.4157     4.7346     1.4158     7.4970     4.3537     5.2800 
   H  67    1.8397     7.1967     7.4970     1.4158     6.2653     8.1444 
   H  68    4.7346     1.8397     6.2653     4.3537     1.4158     2.6009 
   H  69    5.6483     3.1407     3.0755     4.7780     2.2900     4.0601 
   H  70    3.1408     4.0478     5.2004     2.2901     3.0754     5.0309 
   H  71    6.1987     5.6483     2.2900     5.2004     4.7780     6.5557 
   H  72    3.3927     3.1408     5.8275     2.8370     2.2901     4.0601 
   H  73    3.1408     6.8190     6.0634     2.2901     5.8275     7.8126 
   H  74    6.9386     3.3927     2.2901     6.0634     2.8370     4.1198 

              C  13      C  14      C  15      C  16      C  17      C  18
              ------------------------------------------------------------------
   C  13    0.0000 
   C  14    2.0000     0.0000 
   C  15    6.4807     7.7805     0.0000 
   C  16    6.8894     7.8740     1.4142     0.0000 
   C  17    5.0990     6.3668     1.4142     2.0000     0.0000 
   C  18    8.2136     6.4807    11.1355    10.3665    10.0268     0.0000 
   C  19    6.8894     5.0990    10.3665     9.7431     9.1651     1.4142 
   C  20    7.8740     6.3668    10.0268     9.1651     9.0040     1.4142 
   C  21    6.6278     5.3352     8.5440     7.7286     7.5012     2.6457 
   C  22    4.6407     5.4838     2.6457     2.3942     1.5060     8.5440 
   C  23    2.3942     1.5060     6.7228     6.6278     5.3352     5.8995 
   C  24    5.5981     3.9844     8.8882     8.3184     7.6684     2.6458 
   C  25    6.3343     6.9757     2.6457     1.5060     2.3942     8.8882 
   C  26    1.5060     2.3942     5.3985     5.5982     3.9844     7.5403 
   C  27    3.1623     3.1623     5.2031     4.9534     3.8823     6.3975 
   C  28    5.3785     5.6093     4.0000     3.1623     3.1623     7.2111 
   C  29    4.9534     3.8823     7.2111     6.5927     6.0445     4.0000 
   C  30    3.1196     2.5036     6.2019     5.9326     4.8715     5.6157 
   C  31    4.5020     4.9804     3.6055     3.1196     2.5036     7.5498 
   C  32    5.9326     4.8715     7.5498     6.7625     6.5014     3.6055 
   C  33    2.5036     3.1196     4.7341     4.7548     3.3382     7.3204 
   C  34    6.2334     6.5872     3.6055     2.5036     3.1196     7.9372 
   C  35    4.7547     3.3381     7.9373     7.4294     6.6936     3.6056 
   H  36    8.3832     6.8069    10.6452     9.7747     9.6237     1.0698 
   H  37    8.2541     6.8313    10.0006     9.0684     9.0437     1.9038 
   H  38    1.0698     1.9038     7.5258     7.9588     6.1545     8.3832 
   H  39    1.9038     1.9038     8.3832     8.7739     7.0027     8.2541 
   H  40    1.9038     1.0698     8.2541     8.5061     6.8477     7.3818 
   H  41    0.6200     2.0939     5.9775     6.3210     4.5794     7.9588 
   H  42    0.6200     2.6200     6.1545     6.6770     4.8081     8.7739 
   H  43    0.6200     2.0939     7.0027     7.4661     5.6390     8.5061 
   H  44    2.0939     0.6200     8.2203     8.3832     6.8069     6.8477 
   H  45    2.6200     0.6200     8.2405     8.2541     6.8313     5.9775 
   H  46    2.0939     0.6200     7.3666     7.3818     5.9587     6.1545 
   H  47    7.0027     8.2203     0.6200     1.0698     1.9038    11.2486 
   H  48    6.8477     8.2405     0.6200     1.9038     1.9038    11.7484 
   H  49    5.9775     7.3666     0.6200     1.9038     1.0698    11.0561 
   H  50    7.3818     5.9587     9.4085     8.5571     8.3843     1.9038 
   H  51    6.3210     4.5794     9.7698     9.1735     8.5571     1.9038 
   H  52    6.6770     4.8081    10.5468     9.9970     9.3023     1.9038 
   H  53    7.4661     5.6390    10.9658    10.3185     9.7747     1.0698 
   H  54    7.9588     6.1545    11.2486    10.5468    10.0910     0.6200 
   H  55    8.7739     7.0027    11.7484    10.9658    10.6452     0.6200 
   H  56    8.5061     6.8477    11.0561    10.2206    10.0006     0.6200 
   H  57    5.4452     6.8313     1.0698     2.0939     0.6200    10.6452 
   H  58    4.5794     5.9587     1.9038     2.6200     0.6200    10.0006 
   H  59    4.8081     5.9308     1.9038     2.0939     0.6200     9.4085 
   H  60    6.6770     7.5258     1.9038     0.6200     2.0939     9.7698 
   H  61    7.4661     8.3832     1.9038     0.6200     2.6200    10.5468 
   H  62    7.1494     8.2541     1.0698     0.6200     2.0939    10.9658 
   H  63    7.2223     5.9546     8.8161     7.9223     7.8388     2.6008 
   H  64    4.2179     5.2504     2.6009     2.6815     1.2564     8.8161 
   H  65    2.6814     1.2564     7.3405     7.2223     5.9546     5.5322 
   H  66    5.6363     3.8813     9.3512     8.8371     8.0966     2.6009 
   H  67    6.9213     7.5948     2.6009     1.2564     2.6815     9.3512 
   H  68    1.2564     2.6815     5.2800     5.6363     3.8813     8.1444 
   H  69    3.6973     2.8387     6.5557     6.1657     5.2718     5.0310 
   H  70    3.9669     4.3626     4.0601     3.6974     2.8388     7.1975 
   H  71    6.1657     5.2718     7.1975     6.3311     6.2263     4.0601 
   H  72    2.8388     3.6974     4.1198     4.1979     2.7200     7.8126 
   H  73    6.7713     7.0104     4.0601     2.8388     3.6974     7.8437 
   H  74    4.1979     2.7200     7.8437     7.4441     6.5478     4.0601 

              C  19      C  20      C  21      C  22      C  23      C  24
              ------------------------------------------------------------------
   C  19    0.0000 
   C  20    2.0000     0.0000 
   C  21    2.3942     1.5060     0.0000 
   C  22    7.7286     7.5012     6.0000     0.0000 
   C  23    4.6407     5.4838     4.2426     4.2426     0.0000 
   C  24    1.5060     2.3942     1.7321     6.2450     3.2569     0.0000 
   C  25    8.3184     7.6684     6.2450     1.7320     5.6028     6.9282 
   C  26    6.3343     6.9757     5.6028     3.2570     1.7320     4.8989 
   C  27    5.3785     5.6093     4.1468     2.6084     1.7320     3.8730 
   C  28    6.5927     6.0445     4.5826     1.7320     4.1468     5.1962 
   C  29    3.1623     3.1623     1.7320     4.5826     2.6084     1.7321 
   C  30    4.5020     4.9804     3.6056     3.6056     1.0000     3.0119 
   C  31    6.7625     6.5014     5.0000     1.0000     3.6056     5.2915 
   C  32    3.1196     2.5036     1.0000     5.0000     3.6056     2.0000 
   C  33    6.2334     6.5872     5.1373     2.3681     2.0000     4.7396 
   C  34    7.4294     6.6935     5.2915     2.0000     5.1373     6.0828 
   C  35    2.5036     3.1197     2.0000     5.2915     2.3680     1.0000 
   H  36    2.0939     0.6200     2.1242     8.1211     6.0030     2.8243 
   H  37    2.6200     0.6200     1.6788     7.5378     5.8602     2.9036 
   H  38    7.0027     8.2203     7.0975     5.7046     2.9083     5.8584 
   H  39    6.8477     8.2405     7.2388     6.4814     3.2380     5.8480 
   H  40    5.9775     7.3666     6.3864     6.1510     2.5121     4.9733 
   H  41    6.6770     7.5258     6.2235     4.0423     2.0631     5.3190 
   H  42    7.4661     8.3832     7.0955     4.5293     2.9035     6.1447 
   H  43    7.1494     8.2541     7.0635     5.2441     2.8242     5.9292 
   H  44    5.4452     6.8313     5.8676     6.0030     2.1242     4.4375 
   H  45    4.5794     5.9587     5.0294     5.8602     1.6788     3.5645 
   H  46    4.8081     5.9308     4.8237     4.9876     0.8901     3.5815 
   H  47   10.5468    10.0910     8.6289     2.9083     7.0975     9.0888 
   H  48   10.9658    10.6452     9.1610     3.2380     7.2388     9.4829 
   H  49   10.2206    10.0006     8.5036     2.5121     6.3864     8.7271 
   H  50    2.0939     0.6200     0.8901     6.8813     4.9876     2.0632 
   H  51    0.6200     2.0939     2.0631     7.1286     4.0423     0.8901 
   H  52    0.6200     2.6200     2.9035     7.9013     4.5293     1.6788 
   H  53    0.6200     2.0939     2.8242     8.3316     5.2441     2.1242 
   H  54    1.0698     1.9038     2.9083     8.6289     5.7046     2.5121 
   H  55    1.9038     1.9038     3.2380     9.1610     6.4814     3.2380 
   H  56    1.9038     1.0698     2.5121     8.5036     6.1510     2.9083 
   H  57    9.7747     9.6237     8.1211     2.1242     5.8676     8.2758 
   H  58    9.0684     9.0437     7.5378     1.6788     5.0294     7.5635 
   H  59    8.5571     8.3843     6.8813     0.8901     4.8237     7.0632 
   H  60    9.1735     8.5571     7.1286     2.0631     6.2235     7.7641 
   H  61    9.9970     9.3023     7.9013     2.9035     7.0955     8.6048 
   H  62   10.3185     9.7747     8.3316     2.8242     7.0635     8.8815 
   H  63    2.6814     1.2564     0.6200     6.3328     4.8441     2.2901 
   H  64    7.9223     7.8388     6.3328     0.6201     4.1258     6.4222 
   H  65    4.2180     5.2505     4.1259     4.8441     0.6200     2.9252 
   H  66    1.2564     2.6815     2.2901     6.7056     3.3898     0.6200 
   H  67    8.8371     8.0966     6.7056     2.2901     6.2224     7.4716 
   H  68    6.9213     7.5948     6.2224     3.3898     2.2901     5.5002 
   H  69    3.9670     4.3627     2.9871     3.9199     1.4158     2.4635 
   H  70    6.3311     6.2263     4.7206     1.4158     2.9871     4.8399 
   H  71    3.6973     2.8387     1.4158     4.7206     3.9199     2.6200 
   H  72    6.7713     7.0104     5.5334     1.8413     2.6200     5.2692 
   H  73    7.4441     6.5478     5.2100     2.6200     5.5334     6.1648 
   H  74    2.8388     3.6974     2.6200     5.2100     1.8413     1.4158 

              C  25      C  26      C  27      C  28      C  29      C  30
              ------------------------------------------------------------------
   C  25    0.0000 
   C  26    4.8989     0.0000 
   C  27    3.8730     1.7320     0.0000 
   C  28    1.7320     3.8730     2.4495     0.0000 
   C  29    5.1961     3.8730     2.4495     3.4641     0.0000 
   C  30    4.7883     2.0000     1.0000     3.2348     1.8804     0.0000 
   C  31    2.0000     3.0119     1.8804     1.0000     3.6055     2.8284 
   C  32    5.2915     4.7883     3.2348     3.6055     1.0000     2.8284 
   C  33    3.9415     1.0000     1.0000     2.8754     3.4252     1.7320 
   C  34    1.0000     4.7396     3.4252     1.0000     4.3589     4.2341 
   C  35    6.0828     3.9415     2.8754     4.3589     1.0001     2.0179 
   H  36    8.2757     7.5347     6.2050     6.6603     3.7556     5.5469 
   H  37    7.5635     7.2753     5.8202     6.0010     3.4095     5.2758 
   H  38    7.3888     2.5121     4.0478     6.3660     5.5127     3.8024 
   H  39    8.1368     3.2380     4.6200     7.0147     5.7622     4.2100 
   H  40    7.7386     2.9083     4.0478     6.4883     4.9520     3.5086 
   H  41    5.7254     0.8901     2.5815     4.7601     4.5182     2.6488 
   H  42    6.2532     1.6788     3.4095     5.4558     5.3939     3.5256 
   H  43    6.9452     2.1242     3.7556     5.9972     5.4246     3.6354 
   H  44    7.5347     2.8242     3.7556     6.2050     4.4679     3.1229 
   H  45    7.2753     2.9035     3.4095     5.8202     3.7098     2.6112 
   H  46    6.4278     2.0631     2.5815     5.0194     3.3091     1.8848 
   H  47    2.5121     5.8585     5.5127     4.0478     7.3846     6.5117 
   H  48    3.2380     5.8481     5.7622     4.6200     7.8144     6.7578 
   H  49    2.9083     4.9734     4.9520     4.0478     7.0878     5.9409 
   H  50    7.0631     6.4278     5.0194     5.4296     2.5815     4.4281 
   H  51    7.7640     5.7254     4.7601     6.0339     2.5815     3.8823 
   H  52    8.6047     6.2532     5.4558     6.8728     3.4095     4.5262 
   H  53    8.8814     6.9452     5.9972     7.1616     3.7556     5.1218 
   H  54    9.0888     7.3888     6.3660     7.3846     4.0478     5.5240 
   H  55    9.4828     8.1368     7.0147     7.8144     4.6200     6.2242 
   H  56    8.7271     7.7386     6.4883     7.0878     4.0478     5.7729 
   H  57    2.8242     4.4376     4.4679     3.7556     6.6603     5.4494 
   H  58    2.9035     3.5646     3.7098     3.4095     6.0010     4.6693 
   H  59    2.0631     3.5816     3.3091     2.5815     5.4296     4.3054 
   H  60    0.8901     5.3190     4.5182     2.5815     6.0339     5.4773 
   H  61    1.6788     6.1448     5.3939     3.4095     6.8728     6.3541 
   H  62    2.1242     5.9293     5.4246     3.7556     7.1616     6.4156 
   H  63    6.4222     6.1588     4.6463     4.8212     2.2900     4.1704 
   H  64    2.2901     2.9251     2.6269     2.2901     4.8212     3.6189 
   H  65    6.1588     2.2900     2.2900     4.6463     2.6269     1.4158 
   H  66    7.4716     5.0947     4.2462     5.7415     2.2901     3.3209 
   H  67    0.6201     5.5002     4.4920     2.2901     5.7415     5.4019 
   H  68    5.0947     0.6201     2.2901     4.2462     4.4920     2.6200 
   H  69    4.9214     2.6199     1.4157     3.2683     1.2675     0.6200 
   H  70    2.6200     2.4634     1.2674     1.4158     3.2069     2.2353 
   H  71    4.8399     4.9214     3.2683     3.2069     1.4157     3.0483 
   H  72    3.4992     1.4158     1.4158     2.6692     3.8580     2.2901 
   H  73    1.4158     5.2692     3.8580     1.4158     4.4726     4.5913 
   H  74    6.1647     3.4992     2.6692     4.4726     1.4158     1.7113 

              C  31      C  32      C  33      C  34      C  35      H  36
              ------------------------------------------------------------------
   C  31    0.0000 
   C  32    4.0000     0.0000 
   C  33    2.0179     4.2341     0.0000 
   C  34    1.7320     4.3589     3.7416     0.0000 
   C  35    4.3589     1.7321     3.7416     5.2915     0.0000 
   H  36    7.1213     3.1229     7.1766     7.2971     3.6355     0.0000 
   H  37    6.5436     2.6112     6.8134     6.5732     3.5257     0.8768 
   H  38    5.5240     6.5117     3.5086     7.2502     5.1332     8.6822 
   H  39    6.2242     6.7578     4.2100     7.9335     5.2410     8.6571 
   H  40    5.7729     5.9409     3.8024     7.4417     4.3865     7.7805 
   H  41    3.8823     5.4773     1.8848     5.6136     4.4226     8.0571 
   H  42    4.5262     6.3541     2.6112     6.2509     5.2712     8.9065 
   H  43    5.1218     6.4156     3.1229     6.8533     5.1404     8.7412 
   H  44    5.5469     5.4494     3.6354     7.1766     3.8678     7.2433 
   H  45    5.2758     4.6693     3.5256     6.8134     3.0354     6.3668 
   H  46    4.4281     4.3054     2.6488     6.0040     2.8452     6.4010 
   H  47    3.8024     7.6458     5.1332     3.5086     8.1613    10.7057 
   H  48    4.2100     8.1660     5.2410     4.2100     8.5255    11.2638 
   H  49    3.5086     7.5040     4.3866     3.8024     7.7565    10.6206 
   H  50    5.8815     1.8848     6.0040     6.0933     2.6489     1.2400 
   H  51    6.1690     2.6488     5.6136     6.8935     1.8848     2.3532 
   H  52    6.9592     3.5256     6.2509     7.7486     2.6112     2.6924 
   H  53    7.3605     3.6354     6.8533     7.9775     3.1229     2.0000 
   H  54    7.6458     3.8024     7.2502     8.1612     3.5086     1.6640 
   H  55    8.1660     4.2100     7.9335     8.5255     4.2101     1.4142 
   H  56    7.5040     3.5086     7.4417     7.7564     3.8024     0.5374 
   H  57    3.1229     7.1213     3.8679     3.6354     7.2971    10.2435 
   H  58    2.6112     6.5436     3.0355     3.5256     6.5732     9.6609 
   H  59    1.8848     5.8815     2.8453     2.6488     6.0933     9.0040 
   H  60    2.6488     6.1690     4.4227     1.8848     6.8935     9.1651 
   H  61    3.5256     6.9592     5.2712     2.6112     7.7487     9.9033 
   H  62    3.6354     7.3605     5.1405     3.1229     7.9775    10.3854 
   H  63    5.3371     1.4158     5.6443     5.4428     2.6200     1.8543 
   H  64    1.4158     5.3371     2.1518     2.6200     5.4428     8.4567 
   H  65    4.1704     3.6189     2.6199     5.6443     2.1518     5.7329 
   H  66    5.7745     2.6200     5.0492     6.6486     1.4158     3.0084 
   H  67    2.6200     5.7745     4.5513     1.4158     6.6487     8.6962 
   H  68    3.3209     5.4019     1.4158     5.0492     4.5513     8.1522 
   H  69    3.0483     2.2353     2.2900     4.2598     1.4637     4.9327 
   H  70    0.6201     3.7289     1.4636     2.2901     3.8787     6.8430 
   H  71    3.7289     0.6200     4.2598     3.8787     2.2901     3.4536 
   H  72    1.7113     4.5913     0.6201     3.4326     4.2692     7.6108 
   H  73    2.2901     4.3318     4.2692     0.6201     5.4429     7.1368 
   H  74    4.3318     2.2901     3.4326     5.4428     0.6200     4.1880 

              H  37      H  38      H  39      H  40      H  41      H  42
              ------------------------------------------------------------------
   H  37    0.0000 
   H  38    8.6571     0.0000 
   H  39    8.7204     0.8768     0.0000 
   H  40    7.8509     1.2400     0.8768     0.0000 
   H  41    7.8740     1.6640     2.4531     2.2910     0.0000 
   H  42    8.7412     1.4142     2.2910     2.4531     0.8768     0.0000 
   H  43    8.6620     0.5374     1.4142     1.6640     1.2400     0.8768 
   H  44    7.3189     1.6640     1.4142     0.5374     2.3532     2.6924 
   H  45    6.4527     2.4531     2.2910     1.4142     2.6924     3.2400 
   H  46    6.3668     2.2910     2.4531     1.6640     2.0000     2.6924 
   H  47   10.0268     8.0571     8.9065     8.7412     6.4807     6.7020 
   H  48   10.6206     7.8740     8.7412     8.6620     6.3735     6.4807 
   H  49   10.0129     7.0092     7.8740     7.7860     5.4982     5.6222 
   H  50    0.8768     7.7805     7.8509     6.9833     7.0092     7.8740 
   H  51    2.6924     6.4807     6.3735     5.4982     6.0887     6.8894 
   H  52    3.2400     6.7020     6.4807     5.6222     6.5168     7.2705 
   H  53    2.6924     7.5396     7.3436     6.4807     7.2705     8.0492 
   H  54    2.4531     8.0571     7.8740     7.0092     7.7453     8.5358 
   H  55    2.2910     8.9065     8.7412     7.8740     8.5358     9.3418 
   H  56    1.4142     8.7412     8.6620     7.7860     8.2136     9.0484 
   H  57    9.6609     6.4807     7.3436     7.2491     4.9620     5.0990 
   H  58    9.1255     5.6222     6.4807     6.3735     4.0878     4.2531 
   H  59    8.4269     5.8758     6.7020     6.4807     4.2531     4.5831 
   H  60    8.4535     7.7453     8.5358     8.2136     6.0887     6.5168 
   H  61    9.1651     8.5358     9.3418     9.0484     6.8894     7.2705 
   H  62    9.6841     8.2136     9.0484     8.8325     6.6034     6.8894 
   H  63    1.2096     7.7101     7.8583     7.0064     6.8044     7.6788 
   H  64    7.9160     5.2876     6.0945     5.8326     3.6415     4.0478 
   H  65    5.6765     2.9813     3.1407     2.3257     2.4696     3.2487 
   H  66    3.2488     5.7828     5.6806     4.8046     5.4209     6.2106 
   H  67    7.9556     7.9802     8.7378     8.3514     6.3163     6.8190 
   H  68    7.8953     2.3258     3.1408     2.9814     0.6981     1.2096 
   H  69    4.6561     4.3137     4.6468     3.8896     3.2512     4.1272 
   H  70    6.3232     4.9672     5.6435     5.1688     3.3476     4.0422 
   H  71    2.8184     6.8214     7.1307     6.3397     5.6705     6.5429 
   H  72    7.1967     3.8896     4.6469     4.3138     2.2268     2.8184 
   H  73    6.3727     7.7717     8.4294     7.9021     6.1515     6.8156 
   H  74    4.1273     4.5306     4.6220     3.7666     3.9039     4.7346 

              H  43      H  44      H  45      H  46      H  47      H  48
              ------------------------------------------------------------------
   H  43    0.0000 
   H  44    2.0000     0.0000 
   H  45    2.6924     0.8768     0.0000 
   H  46    2.3532     1.2400     0.8768     0.0000 
   H  47    7.5396     8.6822     8.6571     7.7805     0.0000 
   H  48    7.3436     8.6571     8.7204     7.8509     0.8768     0.0000 
   H  49    6.4807     7.7805     7.8509     6.9833     1.2400     0.8768 
   H  50    7.7860     6.4527     5.5898     5.4904     9.4769    10.0268 
   H  51    6.6034     4.9620     4.0878     4.2531     9.9609    10.3665 
   H  52    6.8894     5.0990     4.2531     4.5831    10.7600    11.1364 
   H  53    7.7067     5.9539     5.0990     5.3774    11.1364    11.5673 
   H  54    8.2136     6.4807     5.6222     5.8758    11.3944    11.8556 
   H  55    9.0484     7.3436     6.4807     6.7020    11.8556    12.3619 
   H  56    8.8325     7.2491     6.3735     6.4807    11.1355    11.6731 
   H  57    5.9539     7.2433     7.3189     6.4527     1.6640     1.4142 
   H  58    5.0990     6.3668     6.4527     5.5898     2.4531     2.2910 
   H  59    5.3774     6.4010     6.3668     5.4904     2.2910     2.4531 
   H  60    7.2705     8.0571     7.8740     7.0092     1.6640     2.4531 
   H  61    8.0492     8.9065     8.7412     7.8740     1.4142     2.2910 
   H  62    7.7067     8.7412     8.6620     7.7860     0.5374     1.4142 
   H  63    7.6676     6.4875     5.6483     5.4402     8.8610     9.4357 
   H  64    4.8051     5.7328     5.6764     4.7997     2.9814     3.1408 
   H  65    3.0083     1.8543     1.2096     0.6980     7.7101     7.8583 
   H  66    5.9092     4.2679     3.3927     3.5612     9.5769     9.9375 
   H  67    7.5288     8.1522     7.8953     7.0478     2.3258     3.1408 
   H  68    1.8543     3.0084     3.2488     2.4697     5.7828     5.6806 
   H  69    4.1879     3.4536     2.8184     2.2268     6.8214     7.1307 
   H  70    4.5864     4.9326     4.6560     3.8082     4.3138     4.6469 
   H  71    6.6817     5.8670     5.1231     4.6830     7.2524     7.8169 
   H  72    3.4536     4.1880     4.1273     3.2512     4.5306     4.6220 
   H  73    7.3911     7.6108     7.1967     6.4138     3.8896     4.6469 
   H  74    4.5578     3.2480     2.4194     2.2397     8.1115     8.4157 

              H  49      H  50      H  51      H  52      H  53      H  54
              ------------------------------------------------------------------
   H  49    0.0000 
   H  50    9.3807     0.0000 
   H  51    9.6148     2.0000     0.0000 
   H  52   10.3665     2.6924     0.8768     0.0000 
   H  53   10.8280     2.3532     1.2400     0.8768     0.0000 
   H  54   11.1355     2.2910     1.6640     1.4142     0.5374     0.0000 
   H  55   11.6731     2.4531     2.4531     2.2910     1.4142     0.8768 
   H  56   11.0110     1.6640     2.2910     2.4531     1.6640     1.2400 
   H  57    0.5374     9.0040     9.1651     9.9033    10.3854    10.7057 
   H  58    1.4142     8.4269     8.4535     9.1651     9.6841    10.0268 
   H  59    1.6640     7.7646     7.9509     8.7038     9.1651     9.4769 
   H  60    2.2910     7.9509     8.6108     9.4427     9.7431     9.9609 
   H  61    2.4531     8.7038     9.4427    10.2821    10.5586    10.7600 
   H  62    1.6640     9.1651     9.7431    10.5586    10.8989    11.1364 
   H  63    8.8148     0.6980     2.4696     3.2487     3.0083     2.9813 
   H  64    2.3258     7.2212     7.3118     8.0495     8.5341     8.8610 
   H  65    7.0064     4.7997     3.6416     4.0479     4.8052     5.2877 
   H  66    9.1619     2.4697     0.6981     1.2096     1.8543     2.3258 
   H  67    2.9814     7.5003     8.2942     9.1436     9.3895     9.5769 
   H  68    4.8046     7.0478     6.3163     6.8190     7.5288     7.9802 
   H  69    6.3397     3.8083     3.3477     4.0422     4.5865     4.9673 
   H  70    3.8896     5.6103     5.7264     6.4896     6.9385     7.2524 
   H  71    7.1959     2.2268     3.2512     4.1272     4.1879     4.3137 
   H  72    3.7666     6.4138     6.1515     6.8156     7.3911     7.7717 
   H  73    4.3138     5.9652     6.9371     7.8055     7.9671     8.1115 
   H  74    7.6172     3.2512     2.2268     2.8184     3.4536     3.8896 

              H  55      H  56      H  57      H  58      H  59      H  60
              ------------------------------------------------------------------
   H  55    0.0000 
   H  56    0.8768     0.0000 
   H  57   11.2638    10.6206     0.0000 
   H  58   10.6206    10.0129     0.8768     0.0000 
   H  59   10.0268     9.3807     1.2400     0.8768     0.0000 
   H  60   10.3665     9.6148     2.3532     2.6924     2.0000     0.0000 
   H  61   11.1364    10.3665     2.6924     3.2400     2.6924     0.8768 
   H  62   11.5673    10.8280     2.0000     2.6924     2.3532     1.2400 
   H  63    3.1407     2.3257     8.4567     7.9160     7.2212     7.3118 
   H  64    9.4357     8.8148     1.8543     1.2096     0.6981     2.4697 
   H  65    6.0946     5.8327     6.4875     5.6483     5.4402     6.8044 
   H  66    3.1408     2.9814     8.6962     7.9556     7.5003     8.2942 
   H  67    9.9375     9.1619     3.0084     3.2488     2.4697     0.6981 
   H  68    8.7378     8.3514     4.2679     3.3927     3.5612     5.4209 
   H  69    5.6436     5.1689     5.8670     5.1231     4.6830     5.6705 
   H  70    7.8169     7.1959     3.4536     2.8184     2.2268     3.2512 
   H  71    4.6468     3.8896     6.8430     6.3232     5.6103     5.7264 
   H  72    8.4294     7.9021     3.2480     2.4194     2.2397     3.9039 
   H  73    8.4157     7.6172     4.1880     4.1273     3.2512     2.2268 
   H  74    4.6469     4.3138     7.1368     6.3727     5.9652     6.9371 

              H  61      H  62      H  63      H  64      H  65      H  66
              ------------------------------------------------------------------
   H  61    0.0000 
   H  62    0.8768     0.0000 
   H  63    8.0495     8.5341     0.0000 
   H  64    3.2488     3.0084     6.7065     0.0000 
   H  65    7.6788     7.6676     4.7422     4.7422     0.0000 
   H  66    9.1436     9.3895     2.8059     6.8428     2.9621     0.0000 
   H  67    1.2096     1.8543     6.8428     2.8060     6.7767     8.0261 
   H  68    6.2106     5.9092     6.7767     2.9620     2.8059     5.6753 
   H  69    6.5429     6.6817     3.5566     4.0160     1.6200     2.8329 
   H  70    4.1273     4.1880     5.1140     1.6200     3.5565     5.2915 
   H  71    6.4896     6.9385     1.6200     5.1140     4.0160     3.2400 
   H  72    4.7346     4.5578     6.0070     1.5534     3.2400     5.6090 
   H  73    2.8184     3.4536     5.2915     3.2401     6.0070     6.7523 
   H  74    7.8055     7.9671     3.2400     5.2915     1.5535     1.6200 

              H  67      H  68      H  69      H  70      H  71      H  72
              ------------------------------------------------------------------
   H  67    0.0000 
   H  68    5.6753     0.0000 
   H  69    5.5202     3.2400     0.0000 
   H  70    3.2401     2.8328     2.5077     0.0000 
   H  71    5.2915     5.5202     2.5077     3.5465     0.0000 
   H  72    4.0936     1.6200     2.8059     1.2902     4.5423     0.0000 
   H  73    1.6200     5.6090     4.5423     2.8060     3.7980     4.0011 
   H  74    6.7523     4.0936     1.2903     3.7979     2.8059     4.0011 

              H  73      H  74
              ----------------------
   H  73    0.0000 
   H  74    5.6584     0.0000 



ATOMIC CHARGES
   P   1    0.6508806565
   O   2   -0.3859496535
   O   3   -0.3859496535
   O   4   -0.3859496535
   O   5   -0.1942886752
   C   6   -0.0126684781
   C   7   -0.0126684781
   C   8   -0.0126684781
   C   9   -0.0417518819
   C  10   -0.0417518819
   C  11   -0.0417518819
   C  12   -0.0560435666
   C  13   -0.0560435666
   C  14   -0.0560435666
   C  15   -0.0560435666
   C  16   -0.0560435666
   C  17   -0.0560435666
   C  18   -0.0560435666
   C  19   -0.0560435666
   C  20   -0.0560435666
   C  21   -0.0545995588
   C  22   -0.0545995588
   C  23   -0.0545995588
   C  24   -0.0545995588
   C  25   -0.0545995588
   C  26   -0.0545995588
   C  27    0.1341974266
   C  28    0.1341974266
   C  29    0.1341974266
   C  30   -0.0190462499
   C  31   -0.0190462499
   C  32   -0.0190462499
   C  33   -0.0190462499
   C  34   -0.0190462499
   C  35   -0.0190462499
   H  36    0.0238039167
   H  37    0.0238039167
   H  38    0.0238039167
   H  39    0.0238039167
   H  40    0.0238039167
   H  41    0.0238039167
   H  42    0.0238039167
   H  43    0.0238039167
   H  44    0.0238039167
   H  45    0.0238039167
   H  46    0.0238039167
   H  47    0.0238039167
   H  48    0.0238039167
   H  49    0.0238039167
   H  50    0.0238039167
   H  51    0.0238039167
   H  52    0.0238039167
   H  53    0.0238039167
   H  54    0.0238039167
   H  55    0.0238039167
   H  56    0.0238039167
   H  57    0.0238039167
   H  58    0.0238039167
   H  59    0.0238039167
   H  60    0.0238039167
   H  61    0.0238039167
   H  62    0.0238039167
   H  63    0.0621590833
   H  64    0.0621590833
   H  65    0.0621590833
   H  66    0.0621590833
   H  67    0.0621590833
   H  68    0.0621590833
   H  69    0.0654220799
   H  70    0.0654220799
   H  71    0.0654220799
   H  72    0.0654220799
   H  73    0.0654220799
   H  74    0.0654220799


BOND ANGLES
   2    1    3   O3    P   O3    179.974
   2    1    4   O3    P   O3     90.000
   2    1    5   O3    P   O2     90.000
   3    1    4   O3    P   O3     90.000
   3    1    5   O3    P   O2     90.000
   4    1    5   O3    P   O2    179.974
   1    2   29    P   O3  Car    120.001
   1    3   28    P   O3  Car    120.001
   1    4   27    P   O3  Car    120.001
   9    6   18  Car   C3   C3    179.974
   9    6   19  Car   C3   C3     90.000
   9    6   20  Car   C3   C3     90.000
  18    6   19   C3   C3   C3     90.000
  18    6   20   C3   C3   C3     90.000
  19    6   20   C3   C3   C3    179.974
  10    7   15  Car   C3   C3    179.974
  10    7   16  Car   C3   C3     90.000
  10    7   17  Car   C3   C3     90.000
  15    7   16   C3   C3   C3     90.000
  15    7   17   C3   C3   C3     90.000
  16    7   17   C3   C3   C3    179.974
  11    8   12  Car   C3   C3    179.974
  11    8   13  Car   C3   C3     90.000
  11    8   14  Car   C3   C3     90.000
  12    8   13   C3   C3   C3     90.000
  12    8   14   C3   C3   C3     90.000
  13    8   14   C3   C3   C3    179.974
   6    9   21   C3  Car  Car    120.001
   6    9   24   C3  Car  Car    119.998
  21    9   24  Car  Car  Car    120.001
   7   10   22   C3  Car  Car    120.001
   7   10   25   C3  Car  Car    120.001
  22   10   25  Car  Car  Car    119.999
   8   11   23   C3  Car  Car    120.001
   8   11   26   C3  Car  Car    120.001
  23   11   26  Car  Car  Car    119.999
   8   12   38   C3   C3   HC     90.000
   8   12   39   C3   C3   HC    179.974
   8   12   40   C3   C3   HC     90.000
  38   12   39   HC   C3   HC     90.000
  38   12   40   HC   C3   HC    179.974
  39   12   40   HC   C3   HC     90.000
   8   13   41   C3   C3   HC     90.000
   8   13   42   C3   C3   HC    179.974
   8   13   43   C3   C3   HC     90.000
  41   13   42   HC   C3   HC     90.000
  41   13   43   HC   C3   HC    179.974
  42   13   43   HC   C3   HC     90.000
   8   14   44   C3   C3   HC     90.000
   8   14   45   C3   C3   HC    179.974
   8   14   46   C3   C3   HC     90.000
  44   14   45   HC   C3   HC     90.000
  44   14   46   HC   C3   HC    179.974
  45   14   46   HC   C3   HC     90.000
   7   15   47   C3   C3   HC     90.000
   7   15   48   C3   C3   HC    179.974
   7   15   49   C3   C3   HC     90.000
  47   15   48   HC   C3   HC     90.000
  47   15   49   HC   C3   HC    179.974
  48   15   49   HC   C3   HC     90.000
   7   16   60   C3   C3   HC     90.000
   7   16   61   C3   C3   HC    179.974
   7   16   62   C3   C3   HC     90.000
  60   16   61   HC   C3   HC     90.000
  60   16   62   HC   C3   HC    179.974
  61   16   62   HC   C3   HC     90.000
   7   17   57   C3   C3   HC     90.000
   7   17   58   C3   C3   HC    179.974
   7   17   59   C3   C3   HC     90.000
  57   17   58   HC   C3   HC     90.000
  57   17   59   HC   C3   HC    179.974
  58   17   59   HC   C3   HC     90.000
   6   18   54   C3   C3   HC     90.000
   6   18   55   C3   C3   HC    179.974
   6   18   56   C3   C3   HC     90.000
  54   18   55   HC   C3   HC     90.000
  54   18   56   HC   C3   HC    179.974
  55   18   56   HC   C3   HC     90.000
   6   19   51   C3   C3   HC     90.000
   6   19   52   C3   C3   HC    179.974
   6   19   53   C3   C3   HC     90.000
  51   19   52   HC   C3   HC     90.000
  51   19   53   HC   C3   HC    179.974
  52   19   53   HC   C3   HC     90.000
   6   20   36   C3   C3   HC     90.000
   6   20   37   C3   C3   HC    179.974
   6   20   50   C3   C3   HC     90.000
  36   20   37   HC   C3   HC     90.000
  36   20   50   HC   C3   HC    179.974
  37   20   50   HC   C3   HC     90.000
   9   21   32  Car  Car  Car    120.001
   9   21   63  Car  Car   HC    119.998
  32   21   63  Car  Car   HC    120.002
  10   22   31  Car  Car  Car    120.001
  10   22   64  Car  Car   HC    120.002
  31   22   64  Car  Car   HC    119.997
  11   23   30  Car  Car  Car    120.001
  11   23   65  Car  Car   HC    119.998
  30   23   65  Car  Car   HC    120.002
   9   24   35  Car  Car  Car    119.998
   9   24   66  Car  Car   HC    120.000
  35   24   66  Car  Car   HC    120.002
  10   25   34  Car  Car  Car    120.001
  10   25   67  Car  Car   HC    120.002
  34   25   67  Car  Car   HC    119.997
  11   26   33  Car  Car  Car    120.001
  11   26   68  Car  Car   HC    120.002
  33   26   68  Car  Car   HC    119.997
   4   27   30   O3  Car  Car    120.001
   4   27   33   O3  Car  Car    120.001
  30   27   33  Car  Car  Car    119.999
   3   28   31   O3  Car  Car    120.001
   3   28   34   O3  Car  Car    120.001
  31   28   34  Car  Car  Car    119.999
   2   29   32   O3  Car  Car    120.001
   2   29   35   O3  Car  Car    119.998
  32   29   35  Car  Car  Car    120.001
  23   30   27  Car  Car  Car    120.001
  23   30   69  Car  Car   HC    120.002
  27   30   69  Car  Car   HC    119.998
  22   31   28  Car  Car  Car    120.001
  22   31   70  Car  Car   HC    119.997
  28   31   70  Car  Car   HC    120.002
  21   32   29  Car  Car  Car    120.001
  21   32   71  Car  Car   HC    120.002
  29   32   71  Car  Car   HC    119.998
  26   33   27  Car  Car  Car    120.001
  26   33   72  Car  Car   HC    119.997
  27   33   72  Car  Car   HC    120.002
  25   34   28  Car  Car  Car    120.001
  25   34   73  Car  Car   HC    119.997
  28   34   73  Car  Car   HC    120.002
  24   35   29  Car  Car  Car    119.998
  24   35   74  Car  Car   HC    120.002
  29   35   74  Car  Car   HC    120.000


TORSION ANGLES
   3    1    2   29    180.000
   4    1    2   29    179.974
   5    1    2   29      0.026
   2    1    3   28    180.000
   4    1    3   28      0.026
   5    1    3   28    179.974
   2    1    4   27      0.026
   3    1    4   27    179.974
   5    1    4   27    179.974
   1    2   29   32      0.026
   1    2   29   35    179.974
   1    3   28   31      0.026
   1    3   28   34    179.974
   1    4   27   30      0.026
   1    4   27   33    179.974
  18    6    9   21    180.000
  18    6    9   24    180.000
  19    6    9   21    179.974
  19    6    9   24      0.026
  20    6    9   21      0.026
  20    6    9   24    179.974
   9    6   18   54    180.000
   9    6   18   55    180.000
   9    6   18   56    180.000
  19    6   18   54      0.026
  19    6   18   55    180.000
  19    6   18   56    179.974
  20    6   18   54    179.974
  20    6   18   55    180.000
  20    6   18   56      0.026
   9    6   19   51      0.026
   9    6   19   52    180.000
   9    6   19   53    179.974
  18    6   19   51    179.974
  18    6   19   52    180.000
  18    6   19   53      0.026
  20    6   19   51    180.000
  20    6   19   52    180.000
  20    6   19   53    180.000
   9    6   20   36    179.974
   9    6   20   37    180.000
   9    6   20   50      0.026
  18    6   20   36      0.026
  18    6   20   37    180.000
  18    6   20   50    179.974
  19    6   20   36    180.000
  19    6   20   37    180.000
  19    6   20   50    180.000
  15    7   10   22    180.000
  15    7   10   25    180.000
  16    7   10   22    179.974
  16    7   10   25      0.026
  17    7   10   22      0.026
  17    7   10   25    179.974
  10    7   15   47    180.000
  10    7   15   48    180.000
  10    7   15   49    180.000
  16    7   15   47      0.026
  16    7   15   48    180.000
  16    7   15   49    179.974
  17    7   15   47    179.974
  17    7   15   48    180.000
  17    7   15   49      0.026
  10    7   16   60      0.026
  10    7   16   61    180.000
  10    7   16   62    179.974
  15    7   16   60    179.974
  15    7   16   61    180.000
  15    7   16   62      0.026
  17    7   16   60    180.000
  17    7   16   61    180.000
  17    7   16   62    180.000
  10    7   17   57    179.974
  10    7   17   58    180.000
  10    7   17   59      0.026
  15    7   17   57      0.026
  15    7   17   58    180.000
  15    7   17   59    179.974
  16    7   17   57    180.000
  16    7   17   58    180.000
  16    7   17   59    180.000
  12    8   11   23    180.000
  12    8   11   26    180.000
  13    8   11   23    179.974
  13    8   11   26      0.026
  14    8   11   23      0.026
  14    8   11   26    179.974
  11    8   12   38    180.000
  11    8   12   39    180.000
  11    8   12   40    180.000
  13    8   12   38      0.026
  13    8   12   39    180.000
  13    8   12   40    179.974
  14    8   12   38    179.974
  14    8   12   39    180.000
  14    8   12   40      0.026
  11    8   13   41      0.026
  11    8   13   42    180.000
  11    8   13   43    179.974
  12    8   13   41    179.974
  12    8   13   42    180.000
  12    8   13   43      0.026
  14    8   13   41    180.000
  14    8   13   42    180.000
  14    8   13   43    180.000
  11    8   14   44    179.974
  11    8   14   45    180.000
  11    8   14   46      0.026
  12    8   14   44      0.026
  12    8   14   45    180.000
  12    8   14   46    179.974
  13    8   14   44    180.000
  13    8   14   45    180.000
  13    8   14   46    180.000
   6    9   21   32    179.974
   6    9   21   63      0.026
  24    9   21   32      0.026
  24    9   21   63    179.974
   6    9   24   35    179.974
   6    9   24   66      0.026
  21    9   24   35      0.026
  21    9   24   66    179.974
   7   10   22   31    179.974
   7   10   22   64      0.026
  25   10   22   31      0.026
  25   10   22   64    179.974
   7   10   25   34    179.974
   7   10   25   67      0.026
  22   10   25   34      0.026
  22   10   25   67    179.974
   8   11   23   30    179.974
   8   11   23   65      0.026
  26   11   23   30      0.026
  26   11   23   65    179.974
   8   11   26   33    179.974
   8   11   26   68      0.026
  23   11   26   33      0.026
  23   11   26   68    179.974
   9   21   32   29      0.026
   9   21   32   71    179.974
  63   21   32   29    179.974
  63   21   32   71      0.026
  10   22   31   28      0.026
  10   22   31   70    179.974
  64   22   31   28    179.974
  64   22   31   70      0.026
  11   23   30   27      0.026
  11   23   30   69    179.974
  65   23   30   27    179.974
  65   23   30   69      0.026
   9   24   35   29      0.026
   9   24   35   74    179.974
  66   24   35   29    179.974
  66   24   35   74      0.026
  10   25   34   28      0.026
  10   25   34   73    179.974
  67   25   34   28    179.974
  67   25   34   73      0.026
  11   26   33   27      0.026
  11   26   33   72    179.974
  68   26   33   27    179.974
  68   26   33   72      0.026
   4   27   30   23    179.974
   4   27   30   69      0.026
  33   27   30   23      0.026
  33   27   30   69    179.974
   4   27   33   26    179.974
   4   27   33   72      0.026
  30   27   33   26      0.026
  30   27   33   72    179.974
   3   28   31   22    179.974
   3   28   31   70      0.026
  34   28   31   22      0.026
  34   28   31   70    179.974
   3   28   34   25    179.974
   3   28   34   73      0.026
  31   28   34   25      0.026
  31   28   34   73    179.974
   2   29   32   21    179.974
   2   29   32   71      0.026
  35   29   32   21      0.026
  35   29   32   71    179.974
   2   29   35   24    179.974
   2   29   35   74      0.026
  32   29   35   24      0.026
  32   29   35   74    179.974