* LIGAND DATABASE FILE (OPLS2005)
*
001      73    74    125    191     362
    1     0 S   NP   _N1_     1    28.10806    96.43034   -22.58254
    2     1 S   H    _HN1     2     1.02957    72.78096     5.97399
    3     1 S   H    _H1_     3     1.02834    39.00599   156.49367
    4     1 S   H    _H2_     4     1.02776   101.95216   -99.75409
    5     1 S   CT   _CA1     5     1.50132   141.63429   107.27810
    6     5 S   HC   _HA1     6     1.09574   105.21847    89.81710
    7     5 S   CO3  _C1_     7     1.53781   112.34181   -30.38592
    8     7 S   O2Z  _O11     8     1.26366   114.99166   -44.23917
    9     7 S   O2Z  _O12     9     1.26230   114.92786   134.83228
   10     5 S   CT   _CB1    10     1.53087   107.41591  -152.27096
   11    10 S   HC   HB11    11     1.09828   109.33531   -50.43118
   12    10 S   HC   HB12    12     1.09816   110.42706    66.12023
   13    10 S   CT   _CG1    13     1.53020   112.67891  -171.49391
   14    13 S   HC   HG11    14     1.09595   110.51280   -64.37482
   15    13 S   HC   HG12    15     1.09655   109.91717    54.84278
   16    13 S   C    _CD1    16     1.51838   112.26918   175.21251
   17    16 S   O    _OE1    17     1.22751   123.28942     0.88889
   18    16 S   N    _N2_    18     1.38561   111.74500  -179.23179
   19    18 S   H    _HN2    19     1.01601   118.93777     5.01087
   20    18 S   CT1  _CA2    20     1.45748   122.82038   177.64632
   21    20 S   HC   _HA2    21     1.09712   109.01248    22.10215
   22    20 S   C    _C2_    22     1.52761   107.11341   -95.36591
   23    22 S   O    _O2_    23     1.22937   122.59721   -36.49146
   24    20 S   CT   _CB2    32     1.53100   111.87898   145.39112
   25    24 S   HC   HB21    33     1.09583   110.55070    47.12470
   26    24 S   HC   HB22    34     1.09355   110.31157   165.61817
   27    22 S   N    _N3_    24     1.38576   112.42465   146.51924
   28    27 S   H    _HN3    25     1.01562   119.84885    -1.92874
   29    24 S   S    _SG2    35     1.82782   110.49481   -74.10185
   30    27 S   CT   _CA3    26     1.45453   123.30431   175.22217
   31    30 S   HC   HA31    27     1.09502   109.50188    20.74706
   32    30 S   HC   HA32    28     1.09501   107.11968   137.87702
   33    29 S   CA   _C15    36     1.79649    99.52964   174.86550
   34    30 S   CO3  _C3_    29     1.52933   112.71839  -102.80052
   35    34 S   O2Z  _O31    30     1.26423   115.30842   -48.27009
   36    34 S   O2Z  _O32    31     1.26311   115.09403   132.43114
   37    33 S   CA   _C13    37     1.40500   121.24281   -93.30520
   38    37 S   CA   _C6_    38     1.39447   122.86120  -178.76441
   39    38 S   HA   _H33    39     1.08751   120.94252  -178.86116
   40    37 S   NO2  _N20    71     1.44443   120.89160     1.36315
   41    40 S   ON   _O25    72     1.23732   116.88580    88.33094
   42    40 S   ON   _O29    73     1.23710   116.82926   -92.62902
   43    38 S   CA   _C12    40     1.39506   117.97534     1.01298
   44    43 S   CA   _C8_    41     1.40707   122.84768     0.85134
   45    43 S   NO2  _N19    68     1.44746   116.59732  -178.78856
   46    45 S   ON   _O24    69     1.23742   116.94061   -65.55768
   47    45 S   ON   _O28    70     1.23746   117.05191   113.78065
   48    33 S   CA   _C14    42     1.41618   121.73365    89.02831
   49    44 S   CT   _C17    64     1.50574   121.48531   179.08187
   50    49 S   HC   _H37    65     1.09411   109.92760    85.11821
   51    49 S   HC   _H38    66     1.09382   112.02459  -153.66671
   52    49 S   HC   _H39    67     1.09491   111.36542   -35.84305
   53    48 S   NIX  _N16    43     1.45402   118.92436    -3.06439
   54    53 S   ONX  _O21    44     1.27724   118.48354    86.19334
   55    53 S   NN   _N15    45     1.27553   114.50406   -93.36487
   56    55 S   CA   _C9_    46     1.41163   118.57382   174.33611
   57    56 S   CA   _C4_    47     1.40825   118.89424   -70.77667
   58    57 S   HA   _H31    48     1.08731   118.92872     3.56376
   59    57 S   CA   _C10    49     1.39753   120.47479  -175.77182
   60    59 S   CA   _C5_    50     1.39121   121.09298     0.10653
   61    60 S   HA   _H32    51     1.08681   121.53942   178.67973
   62    59 S   NO2  _N17    61     1.45641   119.29710   178.58570
   63    62 S   ON   _O22    62     1.23849   117.59089   155.17054
   64    62 S   ON   _O26    63     1.23899   117.58813   -24.77759
   65    60 S   CA   _C11    52     1.39774   117.83978     0.44543
   66    56 S   CA   _C7_    53     1.41136   121.15215   113.63154
   67    65 S   NO2  _N18    58     1.44712   116.51362   178.04545
   68    67 S   ON   _O23    59     1.23739   117.19964  -112.63875
   69    67 S   ON   _O27    60     1.23770   116.85954    66.83901
   70    66 S   CT   _C16    54     1.50530   120.58195    -2.15049
   71    70 S   HC   _H34    55     1.09432   109.99932    94.15806
   72    70 S   HC   _H35    56     1.09476   111.35750  -144.52713
   73    70 S   HC   _H36    57     1.09229   111.76813   -26.45125
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   7   5   4   3
  13   2   1   1  10  11   4   4   1   1  10  11   4   1   1   8
   4   2   1   1   5   2   7  12  10   4   8  10   4   3   1   1
   8   7   3   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    48    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    44    48    53    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    43    44    48    53    54    55    49    40    41    42  
   35    36  
   36  
    0  
   38    39    43    44    48    53    45    40    41    42  
   39    43    44    48    49    45    46    47    40    41    42  
   43    44    45    40  
   41    42    43    48  
   42  
    0  
   44    48    53    49    50    51    52    45    46    47  
   48    53    54    55    49    50    51    52    45    46    47  
   46    47    48    49  
   47  
    0  
   53    54    55    56    49    50    51    52  
   50    51    52    53  
   51    52  
   52  
    0  
   54    55    56    57    66  
   55    56  
   56    57    58    59    65    66    70  
   57    58    59    60    65    66    70    71    72    73    67    62  
   58    59    60    61    65    66    70    62    63    64  
   59    60    66    62  
   60    61    65    66    67    62    63    64  
   61    65    66    70    67    68    69    62    63    64  
   65    66    67    62  
   63    64    65  
   64  
    0  
   66    70    71    72    73    67    68    69  
   70    71    72    73    67    68    69  
   68    69    70  
   69  
    0  
   71    72    73  
   72    73  
   73  
    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  -0.320000   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   3.5500   0.0700   0.152500   2.5000   1.7750   0.001000000  -0.843144165
   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   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   39   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   40   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   41   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   42   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   43   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   45   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   46   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   47   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   48   3.5500   0.0700   0.122500   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.2500   0.1200   0.977500   1.9050   1.6860   0.051222218  -2.220205820
   54   2.9600   0.1700  -1.100000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.2500   0.1700  -0.030800   1.8375   1.6250   0.005000000   0.000000000
   56   3.5500   0.0700   0.030800   2.0020   1.7750   0.001000000  -0.843144165
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   63   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   64   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   65   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   66   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   67   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   68   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   69   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   70   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   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   250.000  1.760
   33    37   469.000  1.400
   33    48   469.000  1.400
   37    38   469.000  1.400
   37    40   400.000  1.460
   38    39   367.000  1.080
   38    43   469.000  1.400
   43    44   469.000  1.400
   43    45   400.000  1.460
   44    48   469.000  1.400
   44    49   317.000  1.510
   48    53   315.000  1.443
   53    54   635.000  1.253
   53    55   470.000  1.272
   55    56   370.000  1.400
   56    57   469.000  1.400
   56    66   469.000  1.400
   57    58   367.000  1.080
   57    59   469.000  1.400
   59    60   469.000  1.400
   59    62   400.000  1.460
   60    61   367.000  1.080
   60    65   469.000  1.400
   65    66   469.000  1.400
   65    67   400.000  1.460
   66    70   317.000  1.510
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   67    68   550.000  1.225
   67    69   550.000  1.225
   62    63   550.000  1.225
   62    64   550.000  1.225
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   45    46   550.000  1.225
   45    47   550.000  1.225
   40    41   550.000  1.225
   40    42   550.000  1.225
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  104.20000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    85.00000  119.40000
   29    33    48    85.00000  119.40000
   33    37    38    63.00000  120.00000
   33    37    40    85.00000  120.00000
   33    48    44    63.00000  120.00000
   33    48    53    70.00000  116.91600
   37    38    39    35.00000  120.00000
   37    38    43    63.00000  120.00000
   37    40    41    80.00000  117.50000
   37    40    42    80.00000  117.50000
   38    43    44    63.00000  120.00000
   38    43    45    85.00000  120.00000
   43    38    39    35.00000  120.00000
   43    44    48    63.00000  120.00000
   43    44    49    70.00000  120.00000
   43    45    46    80.00000  117.50000
   43    45    47    80.00000  117.50000
   44    48    53    70.00000  116.91600
   44    49    50    35.00000  109.50000
   44    49    51    35.00000  109.50000
   44    49    52    35.00000  109.50000
   48    33    37    63.00000  120.00000
   48    53    54    90.00000  120.88000
   48    53    55    85.00000  116.84000
   53    55    56    80.00000  114.00000
   55    53    54   100.00000  126.35300
   55    56    57    70.00000  119.16000
   55    56    66    70.00000  119.16000
   56    57    58    35.00000  120.00000
   56    57    59    63.00000  120.00000
   56    66    65    63.00000  120.00000
   56    66    70    70.00000  120.00000
   57    59    60    63.00000  120.00000
   57    59    62    85.00000  120.00000
   59    57    58    35.00000  120.00000
   59    60    61    35.00000  120.00000
   59    60    65    63.00000  120.00000
   59    62    63    80.00000  117.50000
   59    62    64    80.00000  117.50000
   60    65    66    63.00000  120.00000
   60    65    67    85.00000  120.00000
   65    60    61    35.00000  120.00000
   65    66    70    70.00000  120.00000
   65    67    68    80.00000  117.50000
   65    67    69    80.00000  117.50000
   66    56    57    63.00000  120.00000
   66    70    71    35.00000  109.50000
   66    70    72    35.00000  109.50000
   66    70    73    35.00000  109.50000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   67    65    66    85.00000  120.00000
   69    67    68    80.00000  125.30000
   62    59    60    85.00000  120.00000
   64    62    63    80.00000  125.30000
   49    44    48    70.00000  120.00000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   45    43    44    85.00000  120.00000
   47    45    46    80.00000  125.30000
   40    37    38    85.00000  120.00000
   42    40    41    80.00000  125.30000
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  -0.35400  1.0 1.0
   20    24    29    33  -0.24450 -1.0 2.0
   20    24    29    33   0.44000  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   0.63250 -1.0 2.0
   24    29    33    48   0.63250 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   3.62500 -1.0 2.0
   29    33    37    40   3.62500 -1.0 2.0
   29    33    48    44   3.62500 -1.0 2.0
   29    33    48    53   3.62500 -1.0 2.0
   33    37    38    39   3.62500 -1.0 2.0
   33    37    38    43   3.62500 -1.0 2.0
   33    37    40    41   0.69950 -1.0 2.0
   33    37    40    42   0.69950 -1.0 2.0
   33    48    53    54   0.25000 -1.0 2.0
   33    48    53    55   0.25000 -1.0 2.0
   37    33    48    44   3.62500 -1.0 2.0
   37    33    48    53   3.62500 -1.0 2.0
   37    38   -43    44   3.62500 -1.0 2.0
   37    38    43    45   3.62500 -1.0 2.0
   38    37    40    41   0.69950 -1.0 2.0
   38    37    40    42   0.69950 -1.0 2.0
   38    43    44    48   3.62500 -1.0 2.0
   38    43    44    49   3.62500 -1.0 2.0
   38    43    45    46   0.69950 -1.0 2.0
   38    43    45    47   0.69950 -1.0 2.0
   39    38    43    44   3.62500 -1.0 2.0
   39    38    43    45   3.62500 -1.0 2.0
   43    44   -48    33   3.62500 -1.0 2.0
   43    44    48    53   3.62500 -1.0 2.0
   43    44    49    50   0.00000  1.0 1.0
   43    44    49    51   0.00000  1.0 1.0
   43    44    49    52   0.00000  1.0 1.0
   44    43    45    46   0.69950 -1.0 2.0
   44    43    45    47   0.69950 -1.0 2.0
   44    48    53    54   0.25000 -1.0 2.0
   44    48    53    55   0.25000 -1.0 2.0
   48    33   -37    38   3.62500 -1.0 2.0
   48    33    37    40   3.62500 -1.0 2.0
   48    44    49    50   0.00000  1.0 1.0
   48    44    49    51   0.00000  1.0 1.0
   48    44    49    52   0.00000  1.0 1.0
   48    53    55    56   2.00000 -1.0 2.0
   53    55    56    57   1.25000 -1.0 2.0
   53    55    56    66   1.25000 -1.0 2.0
   54    53    55    56   2.00000 -1.0 2.0
   55    56    57    58   3.62500 -1.0 2.0
   55    56    57    59   3.62500 -1.0 2.0
   55    56    66    65   3.62500 -1.0 2.0
   55    56    66    70   3.62500 -1.0 2.0
   56    57    59    60   3.62500 -1.0 2.0
   56    57    59    62   3.62500 -1.0 2.0
   56    66    70    71   0.00000  1.0 1.0
   56    66    70    72   0.00000  1.0 1.0
   56    66    70    73   0.00000  1.0 1.0
   57    56    66    65   3.62500 -1.0 2.0
   57    56    66    70   3.62500 -1.0 2.0
   57    59    60    61   3.62500 -1.0 2.0
   57    59   -60    65   3.62500 -1.0 2.0
   57    59    62    63   0.69950 -1.0 2.0
   57    59    62    64   0.69950 -1.0 2.0
   58    57    59    60   3.62500 -1.0 2.0
   58    57    59    62   3.62500 -1.0 2.0
   59    60    65    66   3.62500 -1.0 2.0
   59    60    65    67   3.62500 -1.0 2.0
   60    59    62    63   0.69950 -1.0 2.0
   60    59    62    64   0.69950 -1.0 2.0
   60    65   -66    56   3.62500 -1.0 2.0
   60    65    66    70   3.62500 -1.0 2.0
   60    65    67    68   0.69950 -1.0 2.0
   60    65    67    69   0.69950 -1.0 2.0
   61    60    65    66   3.62500 -1.0 2.0
   61    60    65    67   3.62500 -1.0 2.0
   65    66    70    71   0.00000  1.0 1.0
   65    66    70    72   0.00000  1.0 1.0
   65    66    70    73   0.00000  1.0 1.0
   66    56    57    58   3.62500 -1.0 2.0
   66    56   -57    59   3.62500 -1.0 2.0
   66    65    67    68   0.69950 -1.0 2.0
   66    65    67    69   0.69950 -1.0 2.0
   67    65    66    56   3.62500 -1.0 2.0
   67    65    66    70   3.62500 -1.0 2.0
   62    59    60    61   3.62500 -1.0 2.0
   62    59    60    65   3.62500 -1.0 2.0
   49    44    48    33   3.62500 -1.0 2.0
   49    44    48    53   3.62500 -1.0 2.0
   45    43    44    48   3.62500 -1.0 2.0
   45    43    44    49   3.62500 -1.0 2.0
   40    37    38    39   3.62500 -1.0 2.0
   40    37    38    43   3.62500 -1.0 2.0
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    48    33    29   4.00000 -1.0 2.0
   38    40    37    33   4.00000 -1.0 2.0
   43    39    38    37   1.10000 -1.0 2.0
   44    45    43    38   4.00000 -1.0 2.0
   48    49    44    43   4.00000 -1.0 2.0
   44    53    48    33   4.00000 -1.0 2.0
   57    66    56    55   4.00000 -1.0 2.0
   59    58    57    56   1.10000 -1.0 2.0
   60    62    59    57   4.00000 -1.0 2.0
   65    61    60    59   1.10000 -1.0 2.0
   66    67    65    60   4.00000 -1.0 2.0
   65    70    66    56   4.00000 -1.0 2.0
   69    65    67    68  10.50000 -1.0 2.0
   64    59    62    63  10.50000 -1.0 2.0
   47    43    45    46  10.50000 -1.0 2.0
   42    37    40    41  10.50000 -1.0 2.0
END
