* LIGAND DATABASE FILE (OPLS2005)
*
001     106   110    209    338     629
    1     0 S   NP   _N1_     1    28.61404    95.41768   -21.16945
    2     1 S   H    _HN1     2     1.02784    89.00954   -97.34738
    3     1 S   H    _H1_     3     1.02951    84.28941    11.19387
    4     1 S   H    _H2_     4     1.02831    36.67926   140.16762
    5     1 S   CT   _CA1     5     1.50110   147.14522   130.63065
    6     5 S   HC   _HA1     6     1.09572   105.22517    65.34801
    7     5 S   CO3  _C1_     7     1.53803   112.34374   -54.92309
    8     7 S   O2Z  _O11     8     1.26372   115.01051   -45.08901
    9     7 S   O2Z  _O12     9     1.26231   114.93295   133.99621
   10     5 S   CT   _CB1    10     1.53077   107.42320  -176.69263
   11    10 S   HC   HB11    11     1.09830   109.43421   -49.88792
   12    10 S   HC   HB12    12     1.09815   110.42934    66.72390
   13    10 S   CT   _CG1    13     1.52984   112.57668  -170.87448
   14    13 S   HC   HG11    14     1.09597   110.56740   -63.72167
   15    13 S   HC   HG12    15     1.09662   109.87617    55.51480
   16    13 S   C    _CD1    16     1.51794   112.24610   175.98190
   17    16 S   O    _OE1    17     1.22735   123.28798     3.26063
   18    16 S   N    _N2_    18     1.38608   111.61774  -176.88938
   19    18 S   H    _HN2    19     1.01592   119.07378     1.95895
   20    18 S   CT1  _CA2    20     1.46316   123.48012   179.53648
   21    20 S   HC   _HA2    21     1.09754   109.29838     0.80697
   22    20 S   C    _C2_    22     1.53583   108.93630  -114.62214
   23    22 S   O    _O2_    23     1.23057   122.31809  -151.38110
   24    20 S   CT   _CB2    32     1.53847   111.32512   122.64085
   25    24 S   HC   HB21    33     1.09250   108.19329    55.58515
   26    24 S   HC   HB22    34     1.09139   109.08241   174.82782
   27    22 S   N    _N3_    24     1.38357   113.76148    36.33833
   28    27 S   H    _HN3    25     1.01585   119.52592    -3.77574
   29    24 S   S    _SG2    35     1.82683   110.07086   -64.72561
   30    27 S   CT   _CA3    26     1.45272   123.15262   176.93887
   31    30 S   HC   HA31    27     1.09552   107.55278   -63.39645
   32    30 S   HC   HA32    28     1.09559   107.92405    53.01397
   33    29 S   CT   _C24    36     1.99723   107.36182  -179.31414
   34    30 S   CO3  _C3_    29     1.52937   114.13611   174.99438
   35    34 S   O2Z  _O31    30     1.26372   116.09329    -0.13562
   36    34 S   O2Z  _O32    31     1.26437   114.40453   179.90309
   37    33 S   CT   _C17    37     1.57741   112.18291   -32.27720
   38    37 S   OM   _O29    38     1.32032   111.73112    68.54973
   39    37 S   HC   _H51    39     1.09620   107.09326  -163.97372
   40    33 S   CT   _C21    62     1.67354   108.97465    97.42939
   41    37 S   CO4  _C10    40     1.53341   112.90187   -54.56744
   42    41 S   O    _O34    41     1.22989   124.53061   143.57225
   43    40 S   CO4  _C8_    63     1.54814   116.06724  -155.31243
   44    43 S   O    _O30    64     1.22897   124.99641    -6.56244
   45    40 S   CT   _C27    99     1.55082   109.27528   -34.82357
   46    45 S   HC   _H58   100     1.09348   112.41680    72.22249
   47    45 S   HC   _H59   101     1.09185   111.31020   -50.48601
   48    45 S   HC   _H60   102     1.08752   114.81430  -167.11452
   49    41 S   OS   _O37    42     1.35853   115.42290   -45.14015
   50    43 S   CT   _C12    65     1.51632   116.48426   176.47485
   51    50 S   HC   _H42    66     1.09772   106.37627   177.75005
   52    50 S   HC   _H43    67     1.08985   108.72254   -69.79221
   53    49 S   CT   _C16    43     1.45123   123.82532    36.06469
   54    53 S   HC   _H50    44     1.09594   104.51922    81.17952
   55    50 S   CT   _C18    68     1.54465   113.84676    57.77223
   56    55 S   HC   _H52    69     1.10080   102.67584    71.23435
   57    53 S   C5BC _C7_    45     1.51158   109.19420  -168.22138
   58    33 S   CT   _C22    53     1.61320   102.41099  -145.18986
   59    94 S   CT   _C23    70     1.61338   116.37002  -154.32089
   60    55 S   CT   _C25    79     1.58576   109.99764  -177.66234
   61    57 S   C5BC _C4_    46     1.42624   127.90849    33.08528
   62    61 S   HA   _H39    47     1.08093   127.33807     0.92026
   63    58 S   CT   _C15    54     1.56715   110.40270   -60.53418
   64    63 S   HC   _H48    55     1.09810   109.44963  -152.83516
   65    63 S   HC   _H49    56     1.09751   110.89509    92.19835
   66    59 S   CT   _C20    71     1.61059   106.81041    57.23059
   67    66 S   HC   _H54    72     1.09390   107.83679   -61.82797
   68    60 S   CT   _C30    80     1.54053   114.26877    52.97083
   69    68 S   HC   _H67    81     1.09756   110.22814   173.60953
   70    68 S   HC   _H68    82     1.09109   112.36467    56.23207
   71    68 S   HC   _H69    83     1.09374   112.76026   -66.68320
   72    60 S   CT   _C31    84     1.54559   111.15327   -67.55636
   73    72 S   HC   _H70    85     1.09640   110.72235  -168.70652
   74    72 S   HC   _H71    86     1.09451   112.10023    70.53165
   75    72 S   HC   _H72    87     1.09494   111.57501   -50.23080
   76    59 S   CT   _C29    95     1.54073   111.29047   -58.08910
   77    76 S   HC   _H64    96     1.09533   111.10458    51.46091
   78    76 S   HC   _H65    97     1.08615   113.82990   -69.65417
   79    76 S   HC   _H66    98     1.09296   112.29883   170.23626
   80    58 S   CT   _C28   103     1.56664   112.75486   177.28848
   81    80 S   HC   _H61   104     1.09535   112.14326   -77.69384
   82    80 S   HC   _H62   105     1.09619   111.32210   163.43248
   83    80 S   HC   _H63   106     1.08678   114.54032    43.03798
   84    61 S   C5A  _C5_    48     1.37428   106.68801  -179.21491
   85    84 S   HA   _H40    49     1.08017   133.82425  -179.76261
   86    63 S   CT   _C14    57     1.53714   116.19228   -30.28734
   87    86 S   HC   _H46    58     1.09450   110.85855    92.26459
   88    86 S   HC   _H47    59     1.09088   106.32544  -154.78478
   89    66 S   CT   _C13    73     1.53006   118.69358   180.00000
   90    89 S   HC   _H44    74     1.09683   110.76211  -174.51173
   91    89 S   HC   _H45    75     1.09512   112.13544    67.26193
   92    66 S   OS   _O39    88     1.45238   109.25947    56.28756
   93    84 S   OA   _O36    50     1.35637   110.47365     0.57709
   94    86 S   CT   _C19    60     1.53084   111.55704   -30.83228
   95    94 S   HC   _H53    61     1.09222   103.89409   -44.88900
   96    89 S   CO4  _C9_    76     1.49313   111.28282   -55.53412
   97    96 S   O    _O33    77     1.22133   125.29052   -98.71370
   98    92 S   CO4  _C11    89     1.36208   118.34136  -141.30463
   99    98 S   O    _O35    90     1.22286   126.50404    -1.27702
  100    57 S   C5A  _C6_    51     1.38226   127.14905  -144.81827
  101   100 S   HA   _H41    52     1.08072   133.44201    -0.75303
  102    96 S   OS   _O38    78     1.35370   108.85950    80.36061
  103    98 S   CT   _C26    91     1.49812   109.37809   178.67411
  104   103 S   HC   _H55    92     1.09291   109.81463   -59.94290
  105   103 S   HC   _H56    93     1.09373   109.37242  -178.92680
  106   103 S   HC   _H57    94     1.09284   109.81147    61.93401
  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
  29   2   1   1  13   6   5  23   6   2  16   6   9   3   2   1
   8  12   5   4  17   6  24   8  10  13  22  15   6   4  11   6
   5  18   8   9   4   3   2   5   3   2   1   8   3   2   1   4
   2   1   1   4   2   4   3   2   8   5   4   8   2   1   1   2
   1   5   4   1   1   1   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    58    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    41    53    58    63    94    40    43    45    80  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    41    42    49    53    54    57    58    63    64    65    86    94    95    40    43    44    50    59    45    46    47    48    80    81    82    83  
   35    36  
   36  
    0  
   38    39    41    42    49    53    58    63    94    40    43    45    80  
   39    41    42    49    58    40  
   41    42    49    58    40  
   43    44    50    51    52    55    59    66    76    45    46    47    48    80    41    53    58    63    86    87    88    94    95  
   42    49    53    54    57    58  
   49    53  
   44    50    51    52    55    56    59    60    45    46    47    48    58    86    94    95  
   50    51    52    55    45    94  
   46    47    48    50    58    59    86    94    95  
   47    48    94  
   48    94  
   94  
   53    54    57    61   100    58    63    80  
   51    52    55    56    59    66   102    60    68    72    76    94  
   52    55    56    59    60  
   55    56    59    60  
   54    57    61    62    84    93   100   101    58    63    64    65    86    80    81    82    83  
   57    61   100    58    63    80  
   56    59    66    67    89    96   102    60    68    69    70    71    72    73    74    75    92    76    77    78    79    86    94    95  
   59    66   102    60    68    72    76    94  
   61    62    84    85    93   100   101    58    63    80  
   63    64    65    86    87    88    94    80    81    82    83    61   100  
   66    67    89    90    91    96   102    60    68    72    92    98    76    77    78    79    63    86    87    88    94    95  
   68    69    70    71    72    73    74    75    76    66    89    94    96    97   102  
   62    84    85    93   100   101  
   84    85    93   100  
   64    65    86    87    88    94    95    80    81    82    83  
   65    86    87    88    94    80  
   86    87    88    94    80  
   67    89    90    91    96    97   102    92    98    99   103    76    77    78    79    86    94    95  
   89    90    91    96    92    98    76    94  
   69    70    71    72    73    74    75    96   102  
   70    71    72   102  
   71    72   102  
   72   102  
   73    74    75    96   102  
   74    75   102  
   75   102  
  102  
   77    78    79    86    89    92    94    95  
   78    79    94  
   79    94  
   94  
   81    82    83    86  
   82    83  
   83  
    0  
   85    93   100   101  
   93   100  
   87    88    94    95  
   88    94    95  
   94    95  
   90    91    96    97   102    92    98    94  
   91    96    97   102    92  
   96    97   102    92  
   98    99   103   104   105   106    94    96  
  100   101  
   95  
    0  
   97   102  
  102  
   99   103   104   105   106  
  103   104   105   106  
  101  
    0  
    0  
  104   105   106  
  105   106  
  106  
    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   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   38   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   52   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   3.5000   0.0660   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   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   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   58   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   59   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   60   3.5000   0.0660   0.250000   1.9750   1.7500   0.005000000  -0.741685710
   61   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   68   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   85   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   86   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   91   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   92   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   93   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   94   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   97   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   98   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   99   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  100   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
  101   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
  102   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
  103   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  105   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  106   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    58   268.000  1.529
   33    40   268.000  1.529
   37    38   570.000  1.307
   37    39   340.000  1.090
   37    41   317.000  1.522
   41    42   570.000  1.229
   41    49   214.000  1.327
   49    53   320.000  1.410
   53    54   340.000  1.090
   53    57   285.000  1.502
   53    58   268.000  1.529
   57    61   469.000  1.424
   57   100   546.000  1.367
   61    62   367.000  1.080
   61    84   546.000  1.367
   84    85   367.000  1.080
   84    93   340.000  1.360
   93   100   340.000  1.360
  100   101   367.000  1.080
   58    63   268.000  1.529
   58    80   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    86   268.000  1.529
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    94   268.000  1.529
   94    95   340.000  1.090
   94    40   268.000  1.529
   94    59   268.000  1.529
   40    43   317.000  1.522
   40    45   268.000  1.529
   43    44   570.000  1.229
   43    50   317.000  1.522
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    55   268.000  1.529
   55    56   340.000  1.090
   55    59   268.000  1.529
   55    60   268.000  1.529
   59    66   268.000  1.529
   59    76   268.000  1.529
   66    67   340.000  1.090
   66    89   268.000  1.529
   66    92   320.000  1.410
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    96   317.000  1.522
   96    97   570.000  1.229
   96   102   214.000  1.327
  102    60   320.000  1.410
   60    68   268.000  1.529
   60    72   268.000  1.529
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    75   340.000  1.090
   92    98   214.000  1.327
   98    99   570.000  1.229
   98   103   317.000  1.522
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
   76    77   340.000  1.090
   76    78   340.000  1.090
   76    79   340.000  1.090
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   340.000  1.090
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    83   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    58    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    50.00000  109.50000
   33    37    39    37.50000  110.70000
   33    37    41    63.00000  111.10000
   33    58    53    58.35000  112.70000
   33    58    63    58.35000  112.70000
   33    58    80    58.35000  112.70000
   33    40    94    58.35000  112.70000
   33    40    43    63.00000  111.10000
   33    40    45    58.35000  112.70000
   37    41    42    80.00000  120.40000
   37    41    49    81.00000  111.40000
   39    37    38    45.00000  125.66300
   41    37    38    90.00000  108.74100
   41    37    39    35.00000  109.50000
   41    49    53    83.00000  116.90000
   49    41    42    83.00000  123.40000
   49    53    54    35.00000  109.50000
   49    53    57    85.00000  111.85700
   49    53    58    50.00000  109.50000
   53    57    61    60.00000  130.00000
   53    57   100    60.00000  130.00000
   53    58    63    58.35000  112.70000
   53    58    80    58.35000  112.70000
   57    53    54    35.00000  109.50000
   57    61    62    35.00000  127.50000
   57    61    84    70.00000  107.30000
   57   100    93    70.00000  110.60000
   57   100   101    35.00000  132.10000
   61    84    85    35.00000  132.10000
   61    84    93    70.00000  110.60000
   84    61    62    35.00000  125.70000
   84    93   100    70.00000  106.50000
   93    84    85    35.00000  113.40000
   93   100   101    35.00000  113.40000
  100    57    61    70.00000  107.30000
   58    33    37    58.35000  112.70000
   58    53    54    37.50000  110.70000
   58    53    57    70.00000  112.17500
   58    63    64    37.50000  110.70000
   58    63    65    37.50000  110.70000
   58    63    86    58.35000  112.70000
   58    80    81    37.50000  110.70000
   58    80    82    37.50000  110.70000
   58    80    83    37.50000  110.70000
   63    86    87    37.50000  110.70000
   63    86    88    37.50000  110.70000
   63    86    94    58.35000  112.70000
   65    63    64    33.00000  107.80000
   86    63    64    37.50000  110.70000
   86    63    65    37.50000  110.70000
   86    94    95    37.50000  110.70000
   86    94    40    58.35000  112.70000
   86    94    59    58.35000  112.70000
   88    86    87    33.00000  107.80000
   94    86    87    37.50000  110.70000
   94    86    88    37.50000  110.70000
   94    40    43    63.00000  111.10000
   94    40    45    58.35000  112.70000
   94    59    55    58.35000  112.70000
   94    59    66    58.35000  112.70000
   94    59    76    58.35000  112.70000
   40    33    37    58.35000  112.70000
   40    33    58    58.35000  112.70000
   40    94    95    37.50000  110.70000
   40    43    44    80.00000  120.40000
   40    43    50    70.00000  116.00000
   40    45    46    37.50000  110.70000
   40    45    47    37.50000  110.70000
   40    45    48    37.50000  110.70000
   43    50    51    35.00000  109.50000
   43    50    52    35.00000  109.50000
   43    50    55    63.00000  111.10000
   50    43    44    80.00000  120.40000
   50    55    56    37.50000  110.70000
   50    55    59    58.35000  112.70000
   50    55    60    58.35000  112.70000
   52    50    51    33.00000  107.80000
   55    50    51    37.50000  110.70000
   55    50    52    37.50000  110.70000
   55    59    66    58.35000  112.70000
   55    59    76    58.35000  112.70000
   55    60   102    50.00000  109.50000
   55    60    68    58.35000  112.70000
   55    60    72    58.35000  112.70000
   59    94    95    37.50000  110.70000
   59    94    40    58.35000  112.70000
   59    55    56    37.50000  110.70000
   59    66    67    37.50000  110.70000
   59    66    89    58.35000  112.70000
   59    66    92    50.00000  109.50000
   59    76    77    37.50000  110.70000
   59    76    78    37.50000  110.70000
   59    76    79    37.50000  110.70000
   66    89    90    37.50000  110.70000
   66    89    91    37.50000  110.70000
   66    89    96    63.00000  111.10000
   66    92    98    83.00000  116.90000
   89    66    67    37.50000  110.70000
   89    96    97    80.00000  120.40000
   89    96   102    81.00000  111.40000
   91    89    90    33.00000  107.80000
   96    89    90    35.00000  109.50000
   96    89    91    35.00000  109.50000
   96   102    60    83.00000  116.90000
  102    96    97    83.00000  123.40000
  102    60    68    50.00000  109.50000
  102    60    72    50.00000  109.50000
   60    55    56    37.50000  110.70000
   60    55    59    58.35000  112.70000
   60    68    69    37.50000  110.70000
   60    68    70    37.50000  110.70000
   60    68    71    37.50000  110.70000
   60    72    73    37.50000  110.70000
   60    72    74    37.50000  110.70000
   60    72    75    37.50000  110.70000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   72    60    68    58.35000  112.70000
   74    72    73    33.00000  107.80000
   75    72    73    33.00000  107.80000
   75    72    74    33.00000  107.80000
   92    66    67    35.00000  109.50000
   92    66    89    50.00000  109.50000
   92    98    99    83.00000  123.40000
   92    98   103    81.00000  111.40000
   98   103   104    35.00000  109.50000
   98   103   105    35.00000  109.50000
   98   103   106    35.00000  109.50000
  103    98    99    80.00000  120.40000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
   76    59    66    58.35000  112.70000
   78    76    77    33.00000  107.80000
   79    76    77    33.00000  107.80000
   79    76    78    33.00000  107.80000
   45    40    43    63.00000  111.10000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    33.00000  107.80000
   80    58    63    58.35000  112.70000
   82    80    81    33.00000  107.80000
   83    80    81    33.00000  107.80000
   83    80    82    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
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   59    55    60    72  -0.07550 -1.0 2.0
   59    55    60    72   0.20000  1.0 3.0
   59    66    89    90   0.15000  1.0 3.0
   59    66    89    91   0.15000  1.0 3.0
   59    66    89    96  -0.95700  1.0 1.0
   59    66    89    96  -0.18200 -1.0 2.0
   59    66    89    96   0.29450  1.0 3.0
   59    66    92    98  -0.25900  1.0 1.0
   59    66    92    98  -0.47000 -1.0 2.0
   59    66    92    98   0.11750  1.0 3.0
   66    59    76    77   0.15000  1.0 3.0
   66    59    76    78   0.15000  1.0 3.0
   66    59    76    79   0.15000  1.0 3.0
   66    89    96    97   0.30150 -1.0 2.0
   66    89    96   102   0.36750  1.0 3.0
   66    92    98    99   3.00000 -1.0 2.0
   66    92    98   103   1.63150  1.0 1.0
   66    92    98   103   2.92000 -1.0 2.0
   67    66    89    90   0.15000  1.0 3.0
   67    66    89    91   0.15000  1.0 3.0
   67    66    89    96  -0.11250  1.0 3.0
   67    66    92    98   0.08050  1.0 3.0
   89    66    92    98  -0.25900  1.0 1.0
   89    66    92    98  -0.47000 -1.0 2.0
   89    66    92    98   0.11750  1.0 3.0
   89    96   102    60   1.63150  1.0 1.0
   89    96   102    60   2.92000 -1.0 2.0
   90    89    96    97   0.00000  1.0 1.0
   90    89    96   102   0.00000  1.0 1.0
   91    89    96    97   0.00000  1.0 1.0
   91    89    96   102   0.00000  1.0 1.0
   96   102    60    55  -0.25900  1.0 1.0
   96   102    60    55  -0.47000 -1.0 2.0
   96   102    60    55   0.11750  1.0 3.0
   96   102    60    68  -0.25900  1.0 1.0
   96   102    60    68  -0.47000 -1.0 2.0
   96   102    60    68   0.11750  1.0 3.0
   96   102    60    72  -0.25900  1.0 1.0
   96   102    60    72  -0.47000 -1.0 2.0
   96   102    60    72   0.11750  1.0 3.0
   97    96   102    60   3.00000 -1.0 2.0
  102    60    68    69   0.23400  1.0 3.0
  102    60    68    70   0.23400  1.0 3.0
  102    60    68    71   0.23400  1.0 3.0
  102    60    72    73   0.23400  1.0 3.0
  102    60    72    74   0.23400  1.0 3.0
  102    60    72    75   0.23400  1.0 3.0
   60    55    59    94   0.56750  1.0 1.0
   60    55    59    94  -0.07550 -1.0 2.0
   60    55    59    94   0.20000  1.0 3.0
   60    55    59    66   0.56750  1.0 1.0
   60    55    59    66  -0.07550 -1.0 2.0
   60    55    59    66   0.20000  1.0 3.0
   60    55    59    76   0.56750  1.0 1.0
   60    55    59    76  -0.07550 -1.0 2.0
   60    55    59    76   0.20000  1.0 3.0
   68    60    72    73   0.15000  1.0 3.0
   68    60    72    74   0.15000  1.0 3.0
   68    60    72    75   0.15000  1.0 3.0
   72    60    68    69   0.15000  1.0 3.0
   72    60    68    70   0.15000  1.0 3.0
   72    60    68    71   0.15000  1.0 3.0
   92    66    89    90   0.23400  1.0 3.0
   92    66    89    91   0.23400  1.0 3.0
   92    66    89    96  -0.09450  1.0 1.0
   92    66    89    96  -1.12950 -1.0 2.0
   92    66    89    96   0.54000  1.0 3.0
   92    98   103   104   0.00000  1.0 1.0
   92    98   103   105   0.00000  1.0 1.0
   92    98   103   106   0.00000  1.0 1.0
   99    98   103   104   0.00000  1.0 1.0
   99    98   103   105   0.00000  1.0 1.0
   99    98   103   106   0.00000  1.0 1.0
   76    59    66    67   0.15000  1.0 3.0
   76    59    66    89   0.56750  1.0 1.0
   76    59    66    89  -0.07550 -1.0 2.0
   76    59    66    89   0.20000  1.0 3.0
   76    59    66    92   0.62750  1.0 1.0
   76    59    66    92  -0.30950 -1.0 2.0
   76    59    66    92   0.27300  1.0 3.0
   45    40    43    44   0.30150 -1.0 2.0
   45    40    43    50   0.60050  1.0 1.0
   45    40    43    50   0.05600 -1.0 2.0
   45    40    43    50   0.26150  1.0 3.0
   80    58    63    64   0.15000  1.0 3.0
   80    58    63    65   0.15000  1.0 3.0
   80    58    63    86   0.56750  1.0 1.0
   80    58    63    86  -0.07550 -1.0 2.0
   80    58    63    86   0.20000  1.0 3.0
IPHI
    9     5     7     8  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
   36    30    34    35  10.50000 -1.0 2.0
   37    49    41    42  10.50000 -1.0 2.0
   61   100    57    53   4.00000 -1.0 2.0
   84    62    61    57   1.10000 -1.0 2.0
   93    85    84    61   1.10000 -1.0 2.0
   93   101   100    57   1.10000 -1.0 2.0
   40    50    43    44  10.50000 -1.0 2.0
   89   102    96    97  10.50000 -1.0 2.0
   92   103    98    99  10.50000 -1.0 2.0
END
