* LIGAND DATABASE FILE (OPLS2005)
*
001      70    74    129    220     384
    1     0 S   NP   _N1_     1    28.81414    96.30639   -23.11237
    2     1 S   H    _HN1     2     1.02950    72.82403    10.53857
    3     1 S   H    _H1_     3     1.02828    38.09202   163.71457
    4     1 S   H    _H2_     4     1.02787   103.78297   -94.75844
    5     1 S   CT   _CA1     5     1.50120   139.78824   112.04413
    6     5 S   HC   _HA1     6     1.09574   105.18145    90.40066
    7     5 S   CO3  _C1_     7     1.53788   112.47437   -29.80967
    8     7 S   O2Z  _O11     8     1.26374   115.00262   -41.98305
    9     7 S   O2Z  _O12     9     1.26240   114.95075   137.10551
   10     5 S   CT   _CB1    10     1.53077   107.41468  -151.61887
   11    10 S   HC   HB11    11     1.09834   109.35997   -49.56357
   12    10 S   HC   HB12    12     1.09813   110.45254    67.04646
   13    10 S   CT   _CG1    13     1.52990   112.61318  -170.53454
   14    13 S   HC   HG11    14     1.09581   110.63881   -66.08880
   15    13 S   HC   HG12    15     1.09672   109.77444    53.14246
   16    13 S   C    _CD1    16     1.51805   112.21005   173.59146
   17    16 S   O    _OE1    17     1.22733   123.28682     7.62766
   18    16 S   N    _N2_    18     1.38650   111.67976  -172.43652
   19    18 S   H    _HN2    19     1.01580   118.92457     1.67736
   20    18 S   CT1  _CA2    20     1.46204   123.41553   177.50880
   21    20 S   HC   _HA2    21     1.09734   109.37206     4.00101
   22    20 S   C    _C2_    22     1.53571   108.67326  -111.55275
   23    22 S   O    _O2_    23     1.23069   122.24450  -147.94651
   24    20 S   CT   _CB2    32     1.53368   111.55033   126.04893
   25    24 S   HC   HB21    33     1.09434   109.65735    56.23794
   26    24 S   HC   HB22    34     1.09499   110.13410   175.33725
   27    22 S   N    _N3_    24     1.38313   113.75737    39.48329
   28    27 S   H    _HN3    25     1.01577   119.59989    -3.26800
   29    24 S   S    _SG2    35     1.82618   111.43291   -64.68575
   30    27 S   CT   _CA3    26     1.45288   123.23073   177.17589
   31    30 S   HC   HA31    27     1.09548   107.50541   -64.76424
   32    30 S   HC   HA32    28     1.09556   107.99392    51.67965
   33    29 S   CT   _C22    36     1.85494   100.21830  -173.18833
   34    33 S   HC   _H3_    37     1.09656   107.32178    41.17477
   35    30 S   CO3  _C3_    29     1.52965   114.07008   173.67954
   36    35 S   O2Z  _O31    30     1.26378   116.06641    -0.69492
   37    35 S   O2Z  _O32    31     1.26428   114.41279   179.36913
   38    33 S   CA   _C20    38     1.51605   110.58246   -80.09221
   39    33 S   CT   _C23    65     1.54327   110.37622   158.46355
   40    39 S   HC   _H4_    66     1.09925   108.55435  -170.05604
   41    38 S   CA   _C21    39     1.40252   120.06561    90.70161
   42    41 S   HA   _H13    40     1.08703   120.51875     5.04065
   43    39 S   OH   _O33    67     1.42654   110.97585   -53.85268
   44    43 S   HO   _H14    68     0.97212   107.69826   -51.86227
   45    41 S   CA   _C4_    41     1.38948   120.27975  -173.48582
   46    45 S   HA   _H5_    42     1.08613   120.11026   179.34449
   47    45 S   CA   _C5_    43     1.39201   119.81389     0.92069
   48    47 S   HA   _H6_    44     1.08819   118.70321   178.15974
   49    47 S   CA   _C6_    45     1.40403   120.73940    -1.76192
   50    49 S   CA   _C7_    46     1.39283   120.66876   178.53981
   51    50 S   HA   _H7_    47     1.08817   120.74433    -0.38765
   52    50 S   CA   _C8_    48     1.39582   120.60165  -179.52112
   53    52 S   HA   _H8_    49     1.08676   116.34001   179.12263
   54    52 S   CA   _C9_    50     1.41273   122.37073    -2.37422
   55    54 S   CA   _C10    51     1.44030   123.26335  -178.35277
   56    54 S   CR3  _C18    63     1.42175   116.85207     0.71409
   57    55 S   CA   _C11    52     1.41957   124.33675    -3.19672
   58    57 S   HA   _H9_    53     1.08623   120.59454    -0.61389
   59    38 S   CR3  _C19    64     1.41812   119.20364   -85.44781
   60    57 S   CA   _C12    54     1.39692   121.76306   179.72660
   61    60 S   CA   _C13    55     1.38354   120.72011    -0.10279
   62    61 S   HA   _H10    56     1.08573   120.83792  -179.94065
   63    60 S   OH   _O34    69     1.36642   121.13140   179.90109
   64    63 S   HO   _H15    70     0.97224   108.73712    -0.29342
   65    61 S   CA   _C14    57     1.39067   119.03569     0.03956
   66    65 S   HA   _H11    58     1.08870   118.37578  -179.89721
   67    55 S   CA   _C15    59     1.41700   119.10516   176.51030
   68    67 S   CA   _C16    60     1.39605   119.92783    -0.45500
   69    68 S   HA   _H12    61     1.08901   119.35306  -177.40459
   70    68 S   CA   _C17    62     1.39850   121.35685     1.92173
  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   9   5   4   3
  14   7   2   1   1  14  11   5   8   4   4   1   6   3   7   3
   8   7   4   8   3  10  13   6   9   4   2   7   7   4   2   1
   5   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    70    59    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    49    68    70    56    59    39    40    43    44  
   38    41    70    59    39    40    43  
   36    37  
   37  
    0  
   41    42    45    46    47    49    50    54    70    56    59    39    40    43  
   40    43    44    41    54    56    59    67    68    69    70  
   43    44    56    68    70  
   42    45    46    47    48    49    56    59  
   45    46    47    59  
   44    56    68    70  
   70  
   46    47    48    49    50    59  
   47    48    49  
   48    49    50    51    52    56    59  
   49    50    59  
   50    51    52    53    54    70    56    59  
   51    52    53    54    55    56    59  
   52    53    54    59  
   53    54    55    57    67    70    56    59  
   54    55    56  
   55    57    58    60    65    67    68    70    56    59  
   57    58    60    61    65    66    67    68    69    70    56    59    63  
   59    57    67    68    69    70  
   58    60    61    62    65    67    68    63    64  
   60    61    67    63  
   68    70  
   61    62    65    66    67    63    64  
   62    65    66    67    68    63    64  
   65    66    67    63  
   64    65  
    0  
   66    67    68    69    70  
   67    68  
   68    69    70  
   69    70  
   70  
    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   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660   0.320000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   49   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.5500   0.0700   0.000000   2.5000   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   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   68   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   69   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   70   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    34   340.000  1.090
   33    38   317.000  1.510
   33    39   268.000  1.529
   38    41   469.000  1.400
   38    59   490.000  1.398
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    47   469.000  1.400
   47    48   367.000  1.080
   47    49   469.000  1.400
   49    50   469.000  1.400
   49    59   490.000  1.398
   50    51   367.000  1.080
   50    52   469.000  1.400
   52    53   367.000  1.080
   52    54   469.000  1.400
   54    55   469.000  1.400
   54    56   490.000  1.398
   55    57   469.000  1.400
   55    67   469.000  1.400
   57    58   367.000  1.080
   57    60   469.000  1.400
   60    61   469.000  1.400
   60    63   450.000  1.364
   61    62   367.000  1.080
   61    65   469.000  1.400
   65    66   367.000  1.080
   65    67   469.000  1.400
   67    68   469.000  1.400
   68    69   367.000  1.080
   68    70   469.000  1.400
   70    56   490.000  1.398
   70    39   317.000  1.510
   56    59   490.000  1.398
   39    40   340.000  1.090
   39    43   320.000  1.410
   43    44   553.000  0.945
   63    64   553.000  0.945
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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    34    35.00000  109.50000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    41    70.00000  120.00000
   33    38    59    80.00000  105.07000
   33    39    70    70.00000  112.17500
   33    39    40    37.50000  110.70000
   33    39    43    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    59    49    60.00000  130.80000
   38    59    56    60.00000  130.80000
   41    45    46    35.00000  120.00000
   41    45    47    63.00000  120.00000
   45    41    42    35.00000  120.00000
   45    47    48    35.00000  120.00000
   45    47    49    63.00000  120.00000
   47    45    46    35.00000  120.00000
   47    49    50    63.00000  120.00000
   47    49    59    70.00000  112.88000
   49    47    48    35.00000  120.00000
   49    50    51    35.00000  120.00000
   49    50    52    63.00000  120.00000
   49    59    56    60.00000  130.80000
   50    52    53    35.00000  120.00000
   50    52    54    63.00000  120.00000
   52    50    51    35.00000  120.00000
   52    54    55    63.00000  120.00000
   52    54    56    70.00000  112.88000
   54    52    53    35.00000  120.00000
   54    55    57    63.00000  120.00000
   54    55    67    63.00000  120.00000
   54    56    70    60.00000  130.80000
   54    56    59    60.00000  130.80000
   55    57    58    35.00000  120.00000
   55    57    60    63.00000  120.00000
   55    67    65    63.00000  120.00000
   55    67    68    63.00000  120.00000
   57    60    61    63.00000  120.00000
   57    60    63    70.00000  120.00000
   60    57    58    35.00000  120.00000
   60    61    62    35.00000  120.00000
   60    61    65    63.00000  120.00000
   60    63    64    35.00000  113.00000
   61    65    66    35.00000  120.00000
   61    65    67    63.00000  120.00000
   65    61    62    35.00000  120.00000
   65    67    68    63.00000  120.00000
   67    55    57    63.00000  120.00000
   67    65    66    35.00000  120.00000
   67    68    69    35.00000  120.00000
   67    68    70    63.00000  120.00000
   68    70    56    70.00000  112.88000
   68    70    39    70.00000  120.00000
   70    68    69    35.00000  120.00000
   70    56    59    60.00000  130.80000
   70    39    40    35.00000  109.50000
   70    39    43    90.00000  112.51600
   56    54    55    70.00000  112.88000
   59    38    41    70.00000  112.88000
   59    49    50    70.00000  112.88000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    70    56    80.00000  105.07000
   39    43    44    55.00000  108.50000
   43    39    40    35.00000  109.50000
   63    60    61    70.00000  120.00000
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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   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    34   0.32350  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    59  -0.16000  1.0 1.0
   29    33    38    59  -0.03200 -1.0 2.0
   29    33    38    59   0.04500  1.0 3.0
   29    33    39    70   0.56750  1.0 1.0
   29    33    39    70  -0.07550 -1.0 2.0
   29    33    39    70   0.20000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    59    49   3.62500 -1.0 2.0
   33    38    59    56   3.62500 -1.0 2.0
   33    39    43    44  -0.11600  1.0 1.0
   33    39    43    44  -0.09450 -1.0 2.0
   33    39    43    44   0.21250  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    59   0.00000  1.0 1.0
   34    33    39    70   0.43200  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    43   0.23400  1.0 3.0
   38    33    39    70  -0.94300  1.0 1.0
   38    33    39    70   1.32550 -1.0 2.0
   38    33    39    70  -0.07100  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    43   1.13150  1.0 1.0
   38    33    39    43  -1.01400 -1.0 2.0
   38    41    45    46   3.62500 -1.0 2.0
   38    41    45    47   3.62500 -1.0 2.0
   41    38    59    49   3.62500 -1.0 2.0
   41    38    59    56   3.62500 -1.0 2.0
   41    45    47    48   3.62500 -1.0 2.0
   41    45   -47    49   3.62500 -1.0 2.0
   42    41    45    46   3.62500 -1.0 2.0
   42    41    45    47   3.62500 -1.0 2.0
   45    47    49    50   3.62500 -1.0 2.0
   45    47    49    59   3.62500 -1.0 2.0
   46    45    47    48   3.62500 -1.0 2.0
   46    45    47    49   3.62500 -1.0 2.0
   47    49    50    51   3.62500 -1.0 2.0
   47    49    50    52   3.62500 -1.0 2.0
   47    49   -59    38   3.62500 -1.0 2.0
   47    49    59    56   3.62500 -1.0 2.0
   48    47    49    50   3.62500 -1.0 2.0
   48    47    49    59   3.62500 -1.0 2.0
   49    50    52    53   3.62500 -1.0 2.0
   49    50    52    54   3.62500 -1.0 2.0
   50    49    59    38   3.62500 -1.0 2.0
   50    49    59    56   3.62500 -1.0 2.0
   50    52    54    55   3.62500 -1.0 2.0
   50    52   -54    56   3.62500 -1.0 2.0
   51    50    52    53   3.62500 -1.0 2.0
   51    50    52    54   3.62500 -1.0 2.0
   52    54    55    57   3.62500 -1.0 2.0
   52    54    55    67   3.62500 -1.0 2.0
   52    54    56    70   3.62500 -1.0 2.0
   52    54    56    59   3.62500 -1.0 2.0
   53    52    54    55   3.62500 -1.0 2.0
   53    52    54    56   3.62500 -1.0 2.0
   54    55    57    58   3.62500 -1.0 2.0
   54    55    57    60   3.62500 -1.0 2.0
   54    55    67    65   3.62500 -1.0 2.0
   54    55    67    68   3.62500 -1.0 2.0
   54    56    59    38   3.62500 -1.0 2.0
   54    56   -59    49   3.62500 -1.0 2.0
   55    54    56    70   3.62500 -1.0 2.0
   55    54    56    59   3.62500 -1.0 2.0
   55    57    60    61   3.62500 -1.0 2.0
   55    57    60    63   3.62500 -1.0 2.0
   55    67    68    69   3.62500 -1.0 2.0
   55    67   -68    70   3.62500 -1.0 2.0
   57    55    67    65   3.62500 -1.0 2.0
   57    55    67    68   3.62500 -1.0 2.0
   57    60    61    62   3.62500 -1.0 2.0
   57    60   -61    65   3.62500 -1.0 2.0
   57    60    63    64   0.84100 -1.0 2.0
   58    57    60    61   3.62500 -1.0 2.0
   58    57    60    63   3.62500 -1.0 2.0
   60    61    65    66   3.62500 -1.0 2.0
   60    61    65    67   3.62500 -1.0 2.0
   61    60    63    64   0.84100 -1.0 2.0
   61    65   -67    55   3.62500 -1.0 2.0
   61    65    67    68   3.62500 -1.0 2.0
   62    61    65    66   3.62500 -1.0 2.0
   62    61    65    67   3.62500 -1.0 2.0
   65    67    68    69   3.62500 -1.0 2.0
   65    67    68    70   3.62500 -1.0 2.0
   66    65    67    55   3.62500 -1.0 2.0
   66    65    67    68   3.62500 -1.0 2.0
   67    55    57    58   3.62500 -1.0 2.0
   67    55   -57    60   3.62500 -1.0 2.0
   67    68    70    56   3.62500 -1.0 2.0
   67    68    70    39   3.62500 -1.0 2.0
   68    70   -56    54   3.62500 -1.0 2.0
   68    70    56    59   3.62500 -1.0 2.0
   68    70    39    33   0.04150 -1.0 2.0
   68    70    39    40   0.00000  1.0 1.0
   68    70    39    43   0.14300 -1.0 2.0
   68    70    39    43   0.00300  1.0 3.0
   69    68    70    56   3.62500 -1.0 2.0
   69    68    70    39   3.62500 -1.0 2.0
   70    56   -59    38   3.62500 -1.0 2.0
   70    56    59    49   3.62500 -1.0 2.0
   70    39    43    44   0.31900  1.0 1.0
   70    39    43    44  -0.11800 -1.0 2.0
   70    39    43    44   0.38750  1.0 3.0
   56    54    55    57   3.62500 -1.0 2.0
   56    54   -55    67   3.62500 -1.0 2.0
   56    70   -39    33   0.04150 -1.0 2.0
   56    70    39    40   0.00000  1.0 1.0
   56    70    39    43   0.14300 -1.0 2.0
   56    70    39    43   0.00300  1.0 3.0
   59    38    41    42   3.62500 -1.0 2.0
   59    38   -41    45   3.62500 -1.0 2.0
   59    49    50    51   3.62500 -1.0 2.0
   59    49   -50    52   3.62500 -1.0 2.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33    38    59   0.04150 -1.0 2.0
   39    70    56    54   3.62500 -1.0 2.0
   39    70   -56    59   3.62500 -1.0 2.0
   40    39    43    44   0.19450  1.0 3.0
   63    60    61    62   3.62500 -1.0 2.0
   63    60    61    65   3.62500 -1.0 2.0
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
   36    30    35    37  10.50000 -1.0 2.0
   41    59    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   47    46    45    41   1.10000 -1.0 2.0
   49    48    47    45   1.10000 -1.0 2.0
   50    59    49    47   4.00000 -1.0 2.0
   52    51    50    49   1.10000 -1.0 2.0
   54    53    52    50   1.10000 -1.0 2.0
   55    56    54    52   4.00000 -1.0 2.0
   57    67    55    54   4.00000 -1.0 2.0
   60    58    57    55   1.10000 -1.0 2.0
   61    63    60    57   4.00000 -1.0 2.0
   65    62    61    60   1.10000 -1.0 2.0
   67    66    65    61   1.10000 -1.0 2.0
   65    68    67    55   4.00000 -1.0 2.0
   70    69    68    67   1.10000 -1.0 2.0
   56    39    70    68   4.00000 -1.0 2.0
   70    59    56    54   4.00000 -1.0 2.0
   49    56    59    38   4.00000 -1.0 2.0
END
