* LIGAND DATABASE FILE (OPLS2005)
*
001     100   103    199    325     604
    1     0 S   NP   _N1_     1    29.13052    95.17046   -18.51634
    2     1 S   H    _HN1     2     1.02963   103.75977    39.06746
    3     1 S   H    _H1_     3     1.02838    42.19514   139.45445
    4     1 S   H    _H2_     4     1.02780    69.25328   -65.56408
    5     1 S   CT   _CA1     5     1.50102   142.51860  -165.36979
    6     5 S   HC   _HA1     6     1.09567   105.31842    23.21317
    7     5 S   CO3  _C1_     7     1.53903   112.17524   -97.17593
    8     7 S   O2Z  _O11     8     1.26367   115.05144   -47.76083
    9     7 S   O2Z  _O12     9     1.26235   114.90088   131.37215
   10     5 S   CT   _CB1    10     1.53073   107.41969   141.20059
   11    10 S   HC   HB11    11     1.09817   109.65407   -49.58481
   12    10 S   HC   HB12    12     1.09841   110.25283    66.99284
   13    10 S   CT   _CG1    13     1.53036   112.61736  -170.70014
   14    13 S   HC   HG11    14     1.09579   110.23426   -55.78526
   15    13 S   HC   HG12    15     1.09590   110.35272    63.43014
   16    13 S   C    _CD1    16     1.51769   111.75514  -176.25263
   17    16 S   O    _OE1    17     1.22745   123.06983   -18.11659
   18    16 S   N    _N2_    18     1.38551   111.80401   161.98046
   19    18 S   H    _HN2    19     1.01588   119.04896     3.67045
   20    18 S   CT1  _CA2    20     1.46231   123.37843  -172.41473
   21    20 S   HC   _HA2    21     1.09729   109.34153   -19.14339
   22    20 S   C    _C2_    22     1.53339   108.34739  -135.13117
   23    22 S   O    _O2_    23     1.23003   122.30349  -145.64595
   24    20 S   CT   _CB2    32     1.53934   111.08240   102.83977
   25    24 S   HC   HB21    33     1.09142   109.05368    56.88563
   26    24 S   HC   HB22    34     1.09408   109.80040   174.58630
   27    22 S   N    _N3_    24     1.38525   113.27086    41.73670
   28    27 S   H    _HN3    25     1.01541   118.88599    -0.56197
   29    24 S   S    _SG2    35     1.83272   111.13157   -66.40256
   30    27 S   CT   _CA3    26     1.45441   123.39864   175.10279
   31    30 S   HC   HA31    27     1.09527   109.16710    25.59356
   32    30 S   HC   HA32    28     1.09493   107.13709   142.58757
   33    29 S   CT   _C17    36     1.90311   104.86466   153.53665
   34    30 S   CO3  _C3_    29     1.52930   113.17576   -97.83453
   35    34 S   O2Z  _O31    30     1.26398   115.43569   -43.82163
   36    34 S   O2Z  _O32    31     1.26360   114.96334   137.12861
   37    33 S   CT   _C18    37     1.56214   102.04828   155.01481
   38    37 S   HC   _H19    38     1.09782   111.25726   -51.99820
   39    37 S   HC   _H20    39     1.09439   112.00060  -170.06989
   40    33 S   CT   _C5_    56     1.56904   111.42304    37.98319
   41    40 S   HC   _H3_    57     1.09526   108.83803   -61.23214
   42    37 S   CO4  _C19    40     1.51625   113.67711    69.54409
   43    42 S   O    _O33    41     1.23121   121.29228  -136.99030
   44    40 S   CT   _C4_    58     1.54141   115.02973    58.41697
   45    44 S   HC   _H8_    59     1.09498   111.72081    67.99471
   46    44 S   HC   _H9_    60     1.09160   112.95617   -53.85513
   47    44 S   HC   _H10    61     1.09625   110.06153  -173.20295
   48    42 S   CT   _C20    42     1.50559   117.17662    48.99201
   49    48 S   HC   _H21    43     1.09395   108.49309    75.06445
   50    48 S   HC   _H22    44     1.09569   108.71398  -168.30703
   51    48 S   CT   _C21    45     1.52036   110.80385   -48.16040
   52    51 S   HC   _H23    46     1.09627   108.88283   176.66769
   53    51 S   HC   _H24    47     1.09784   108.26395   -70.26555
   54    33 S   CT   _C16    48     1.60978   112.60256   -87.76948
   55    54 S   CT   _C15    49     1.59642   109.17990   179.56840
   56    55 S   HC   _H7_    50     1.09809   106.56504    57.75095
   57    54 S   CT   _C22    97     1.55087   111.43076    57.03289
   58    57 S   HC   _H25    98     1.09225   112.82229    62.22408
   59    57 S   HC   _H26    99     1.09134   111.66107   -59.67014
   60    57 S   HC   _H27   100     1.09120   112.52269  -175.53226
   61    55 S   CT   _C7_    51     1.55667   111.95568   -56.39558
   62    61 S   HC   _H4_    52     1.09431   109.93005   -63.45499
   63    55 S   CT   _C14    75     1.56403   116.75165   172.05031
   64    63 S   HC   _H6_    76     1.09558   108.67061   -61.89729
   65    61 S   CT   _C6_    53     1.53494   111.03896    55.77044
   66    65 S   HC   _H11    54     1.09757   109.54672    70.67403
   67    65 S   HC   _H12    55     1.09809   108.72612  -174.30897
   68    61 S   CT   _C8_    62     1.54113   109.13278   176.44504
   69    68 S   HC   _H5_    63     1.10296   105.95480   -59.79783
   70    63 S   OH   _O34    77     1.41837   112.26207    55.65903
   71    70 S   HO   _H28    78     0.97242   107.87765  -172.48864
   72    68 S   CT   _C9_    64     1.52376   118.29026  -178.21524
   73    72 S   HC   _H13    65     1.09484   112.15265    76.17477
   74    72 S   HC   _H14    66     1.09589   111.42359   -44.48389
   75    72 S   CT   _C10    67     1.53920   104.28766  -163.66161
   76    75 S   HC   _H15    68     1.09521   108.47252   132.36865
   77    75 S   HC   _H16    69     1.09618   109.79234  -110.68499
   78    75 S   CT   _C11    70     1.55632   106.76057    10.25156
   79    68 S   CT   _C12    71     1.54687   114.41042    59.25545
   80    78 S   CO4  _C24    83     1.53900   112.82896   144.71043
   81    80 S   O    _O35    84     1.23282   121.54066    -4.13470
   82    78 S   OH   _O38    95     1.42823   107.90312   -98.35169
   83    82 S   HO   _H37    96     0.97306   108.22069   -56.02790
   84    79 S   CT   _C13    72     1.54431   106.28969   -61.35342
   85    84 S   HC   _H17    73     1.09703   110.06842   -64.50679
   86    84 S   HC   _H18    74     1.09463   109.93871   178.27478
   87    79 S   CT   _C23    79     1.55170   113.05019    61.03571
   88    87 S   HC   _H29    80     1.09510   112.45180    69.87314
   89    87 S   HC   _H30    81     1.09162   113.21944   -50.30351
   90    87 S   HC   _H31    82     1.09541   110.74704  -170.67616
   91    80 S   CT   _C25    85     1.52050   117.60195   175.70604
   92    91 S   HC   _H32    86     1.09258   108.81181    75.33525
   93    91 S   HC   _H33    87     1.09370   109.66180   -46.73932
   94    91 S   OS   _O36    88     1.43047   108.64073  -165.96129
   95    94 S   CO4  _C26    89     1.36258   115.23355  -178.31937
   96    95 S   O    _O37    90     1.22340   126.18607    -0.06853
   97    95 S   CT   _C27    91     1.49832   109.63404   179.93744
   98    97 S   HC   _H34    92     1.09289   109.83449   -60.92012
   99    97 S   HC   _H35    93     1.09380   109.35694  -179.96044
  100    97 S   HC   _H36    94     1.09289   109.83505    60.99705
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  13   5   4   3
  27   2   1   1  15   6   5  16   9   8   4   8   3   2   1   8
   5   4  11   4   3  14  21   9   5   2   1   1  17   8  11   6
   6   2   1  18   8   5   1  11   6   5  11   5   4  16  12  10
   5   4   1   6   2   1   3   2   1   1   6   3   2   6   5   4
   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    54    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    42    51    54    55    65    40    41    44    57  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    42    43    48    51    52    53    54    55    56    61    65    66    67    40    41    44    45    46    47    63    57    58    59    60  
   35    36  
   36  
    0  
   38    39    42    43    48    49    50    51    54    55    65    40    41    44    57  
   39    42    43    48    54    40  
   42    43    48    54    40  
   41    44    45    46    47    68    57    42    51    54    55    61    62    65    66    67  
   44    45    46    47    54    61    65    66    67  
   43    48    49    50    51    52    53    54  
   48    49    50    51  
   45    46    47    54    61    65    66    67  
   46    47    65  
   47    65  
   65  
   49    50    51    52    53    54    55    57  
   50    51    52    53    54  
   51    52    53    54  
   52    53    54    55    56    61    63    57    58    59    60  
   53    54    55    57  
   54    55    57  
   55    56    61    62    65    68    84    63    64    70    57    58    59    60  
   56    61    62    65    66    67    68    69    72    79    84    85    86    63    64    70    71    57    58    59    60  
   61    62    65    68    84    63    64    70    57  
   58    59    60    61    63  
   59    60  
   60  
    0  
   62    65    66    67    68    69    72    73    74    75    78    79    84    63    64    70    87  
   65    66    67    68    69    72    79    63  
   64    70    71    87    65    68    78    79    84    85    86  
   70    71    79    84    85    86  
   66    67    68    69    72    79  
   67    68  
   68  
   69    72    73    74    75    76    77    78    79    84    85    86    87    88    89    90    80    82  
   72    73    74    75    78    79    84    87  
   71    79    84    85    86  
   84  
   73    74    75    76    77    78    79    84    87    80    82  
   74    75    76    77    78    79  
   75    76    77    78    79  
   76    77    78    79    84    87    80    81    91    82    83  
   77    78    79    80    82  
   78    79    80    82  
   79    84    85    86    87    88    89    90    80    81    91    92    93    94    82    83  
   84    85    86    87    88    89    90    80    81    91    82    83  
   81    91    92    93    94    95    82    83    84    87  
   91    92    93    94    82  
   83    84    87    91  
    0  
   85    86    87    88    89    90  
   86    87  
   87  
   88    89    90  
   89    90  
   90  
    0  
   92    93    94    95    96    97  
   93    94    95  
   94    95  
   95    96    97    98    99   100  
   96    97    98    99   100  
   97    98    99   100  
   98    99   100  
   99   100  
  100  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   72   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   79   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   80   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   81   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   82   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   83   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   84   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660   0.238000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   93   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   94   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   95   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   96   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   97   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   99   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  100   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    54   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    42   317.000  1.522
   42    43   570.000  1.229
   42    48   317.000  1.522
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   268.000  1.529
   54    55   268.000  1.529
   54    57   268.000  1.529
   55    56   340.000  1.090
   55    61   268.000  1.529
   55    63   268.000  1.529
   61    62   340.000  1.090
   61    65   268.000  1.529
   61    68   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    40   268.000  1.529
   40    41   340.000  1.090
   40    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   68    69   340.000  1.090
   68    72   268.000  1.529
   68    79   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    75   268.000  1.529
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    78   268.000  1.529
   78    79   268.000  1.529
   78    80   317.000  1.522
   78    82   320.000  1.410
   79    84   268.000  1.529
   79    87   268.000  1.529
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    63   268.000  1.529
   63    64   340.000  1.090
   63    70   320.000  1.410
   70    71   553.000  0.945
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    90   340.000  1.090
   80    81   570.000  1.229
   80    91   317.000  1.522
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    94   320.000  1.410
   94    95   214.000  1.327
   95    96   570.000  1.229
   95    97   317.000  1.522
   97    98   340.000  1.090
   97    99   340.000  1.090
   97   100   340.000  1.090
   82    83   553.000  0.945
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    54    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    42    63.00000  111.10000
   33    54    51    58.35000  112.70000
   33    54    55    58.35000  112.70000
   33    54    57    58.35000  112.70000
   33    40    65    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    44    58.35000  112.70000
   37    42    43    80.00000  120.40000
   37    42    48    70.00000  116.00000
   39    37    38    33.00000  107.80000
   42    37    38    35.00000  109.50000
   42    37    39    35.00000  109.50000
   42    48    49    35.00000  109.50000
   42    48    50    35.00000  109.50000
   42    48    51    63.00000  111.10000
   48    42    43    80.00000  120.40000
   48    51    52    37.50000  110.70000
   48    51    53    37.50000  110.70000
   48    51    54    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    48    49    37.50000  110.70000
   51    48    50    37.50000  110.70000
   51    54    55    58.35000  112.70000
   51    54    57    58.35000  112.70000
   53    51    52    33.00000  107.80000
   54    33    37    58.35000  112.70000
   54    51    52    37.50000  110.70000
   54    51    53    37.50000  110.70000
   54    55    56    37.50000  110.70000
   54    55    61    58.35000  112.70000
   54    55    63    58.35000  112.70000
   54    57    58    37.50000  110.70000
   54    57    59    37.50000  110.70000
   54    57    60    37.50000  110.70000
   55    61    62    37.50000  110.70000
   55    61    65    58.35000  112.70000
   55    61    68    58.35000  112.70000
   55    63    84    58.35000  112.70000
   55    63    64    37.50000  110.70000
   55    63    70    50.00000  109.50000
   61    55    56    37.50000  110.70000
   61    65    66    37.50000  110.70000
   61    65    67    37.50000  110.70000
   61    65    40    58.35000  112.70000
   61    68    69    37.50000  110.70000
   61    68    72    58.35000  112.70000
   61    68    79    58.35000  112.70000
   65    61    62    37.50000  110.70000
   65    40    41    37.50000  110.70000
   65    40    44    58.35000  112.70000
   67    65    66    33.00000  107.80000
   40    33    37    58.35000  112.70000
   40    33    54    58.35000  112.70000
   40    65    66    37.50000  110.70000
   40    65    67    37.50000  110.70000
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    47    37.50000  110.70000
   44    40    41    37.50000  110.70000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   68    61    62    37.50000  110.70000
   68    61    65    58.35000  112.70000
   68    72    73    37.50000  110.70000
   68    72    74    37.50000  110.70000
   68    72    75    58.35000  112.70000
   68    79    78    58.35000  112.70000
   68    79    84    58.35000  112.70000
   68    79    87    58.35000  112.70000
   72    68    69    37.50000  110.70000
   72    75    76    37.50000  110.70000
   72    75    77    37.50000  110.70000
   72    75    78    58.35000  112.70000
   74    72    73    33.00000  107.80000
   75    72    73    37.50000  110.70000
   75    72    74    37.50000  110.70000
   75    78    79    58.35000  112.70000
   75    78    80    63.00000  111.10000
   75    78    82    50.00000  109.50000
   77    75    76    33.00000  107.80000
   78    75    76    37.50000  110.70000
   78    75    77    37.50000  110.70000
   78    79    84    58.35000  112.70000
   78    79    87    58.35000  112.70000
   78    80    81    80.00000  120.40000
   78    80    91    70.00000  116.00000
   78    82    83    55.00000  108.50000
   79    68    69    37.50000  110.70000
   79    68    72    58.35000  112.70000
   79    84    85    37.50000  110.70000
   79    84    86    37.50000  110.70000
   79    84    63    58.35000  112.70000
   79    87    88    37.50000  110.70000
   79    87    89    37.50000  110.70000
   79    87    90    37.50000  110.70000
   84    63    64    37.50000  110.70000
   84    63    70    50.00000  109.50000
   86    84    85    33.00000  107.80000
   63    55    56    37.50000  110.70000
   63    55    61    58.35000  112.70000
   63    84    85    37.50000  110.70000
   63    84    86    37.50000  110.70000
   63    70    71    55.00000  108.50000
   70    63    64    35.00000  109.50000
   87    79    84    58.35000  112.70000
   89    87    88    33.00000  107.80000
   90    87    88    33.00000  107.80000
   90    87    89    33.00000  107.80000
   80    78    79    63.00000  111.10000
   80    91    92    35.00000  109.50000
   80    91    93    35.00000  109.50000
   80    91    94    90.00000  108.74100
   91    80    81    80.00000  120.40000
   91    94    95    83.00000  116.90000
   93    91    92    33.00000  107.80000
   94    91    92    35.00000  109.50000
   94    91    93    35.00000  109.50000
   94    95    96    83.00000  123.40000
   94    95    97    81.00000  111.40000
   95    97    98    35.00000  109.50000
   95    97    99    35.00000  109.50000
   95    97   100    35.00000  109.50000
   97    95    96    80.00000  120.40000
   99    97    98    33.00000  107.80000
  100    97    98    33.00000  107.80000
  100    97    99    33.00000  107.80000
   82    78    79    50.00000  109.50000
   82    78    80    90.00000  109.61100
   57    54    55    58.35000  112.70000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
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   80    78    79    87  -0.95700  1.0 1.0
   80    78    79    87  -0.18200 -1.0 2.0
   80    78    79    87   0.29450  1.0 3.0
   80    78    82    83   0.91850  1.0 1.0
   80    78    82    83   0.57950  1.0 3.0
   80    91    94    95  -1.80650  1.0 1.0
   80    91    94    95   0.63900 -1.0 2.0
   80    91    94    95   0.03650  1.0 3.0
   81    80    91    92   0.00000  1.0 1.0
   81    80    91    93   0.00000  1.0 1.0
   81    80    91    94   0.30150 -1.0 2.0
   91    94    95    96   3.00000 -1.0 2.0
   91    94    95    97   1.63150  1.0 1.0
   91    94    95    97   2.92000 -1.0 2.0
   92    91    94    95   0.08050  1.0 3.0
   93    91    94    95   0.08050  1.0 3.0
   94    95    97    98   0.00000  1.0 1.0
   94    95    97    99   0.00000  1.0 1.0
   94    95    97   100   0.00000  1.0 1.0
   96    95    97    98   0.00000  1.0 1.0
   96    95    97    99   0.00000  1.0 1.0
   96    95    97   100   0.00000  1.0 1.0
   82    78    79    68   0.86500  1.0 1.0
   82    78    79    68  -0.17500 -1.0 2.0
   82    78    79    68   0.20800  1.0 3.0
   82    78    79    84   0.86500  1.0 1.0
   82    78    79    84  -0.17500 -1.0 2.0
   82    78    79    84   0.20800  1.0 3.0
   82    78    79    87   0.86500  1.0 1.0
   82    78    79    87  -0.17500 -1.0 2.0
   82    78    79    87   0.20800  1.0 3.0
   82    78    80    81   0.30150 -1.0 2.0
   82    78    80    91   0.55300  1.0 1.0
   82    78    80    91   1.25850 -1.0 2.0
   82    78    80    91  -0.23600  1.0 3.0
   57    54    55    56   0.15000  1.0 3.0
   57    54    55    61   0.56750  1.0 1.0
   57    54    55    61  -0.07550 -1.0 2.0
   57    54    55    61   0.20000  1.0 3.0
   57    54    55    63   0.56750  1.0 1.0
   57    54    55    63  -0.07550 -1.0 2.0
   57    54    55    63   0.20000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   37    48    42    43  10.50000 -1.0 2.0
   78    91    80    81  10.50000 -1.0 2.0
   94    97    95    96  10.50000 -1.0 2.0
END
