* LIGAND DATABASE FILE (OPLS2005)
*
001      65    66    113    181     335
    1     0 S   NP   _N1_     1    28.89144    95.34874   -20.41738
    2     1 S   H    _HN1     2     1.02959    88.05001    28.71587
    3     1 S   H    _H1_     3     1.02839    36.58617   151.12964
    4     1 S   H    _H2_     4     1.02777    85.27496   -79.89692
    5     1 S   CT   _CA1     5     1.50102   147.25367   154.98801
    6     5 S   HC   _HA1     6     1.09564   105.26453    56.65668
    7     5 S   CO3  _C1_     7     1.53763   112.52780   -63.69592
    8     7 S   O2Z  _O11     8     1.26365   114.96886   -39.98795
    9     7 S   O2Z  _O12     9     1.26225   114.97729   139.52490
   10     5 S   CT   _CB1    10     1.53108   107.48798   174.80269
   11    10 S   HC   HB11    11     1.09818   109.42848   -49.38173
   12    10 S   HC   HB12    12     1.09825   110.38515    67.24765
   13    10 S   CT   _CG1    13     1.52972   112.62273  -170.45400
   14    13 S   HC   HG11    14     1.09501   110.50184   -62.35734
   15    13 S   HC   HG12    15     1.09651   109.99445    56.74803
   16    13 S   C    _CD1    16     1.51763   112.38562   176.99033
   17    16 S   O    _OE1    17     1.22708   123.29333    -5.94590
   18    16 S   N    _N2_    18     1.38568   111.54545   174.64427
   19    18 S   H    _HN2    19     1.01601   118.95387    -0.10653
   20    18 S   CT1  _CA2    20     1.46178   123.50988   179.31073
   21    20 S   HC   _HA2    21     1.09729   109.44151   -12.76353
   22    20 S   C    _C2_    22     1.53447   108.13063  -128.36144
   23    22 S   O    _O2_    23     1.23009   122.27238  -145.40461
   24    20 S   CT   _CB2    32     1.53273   111.28758   109.56966
   25    24 S   HC   HB21    33     1.09504   109.69604    53.98546
   26    24 S   HC   HB22    34     1.09512   110.72557   172.14852
   27    22 S   N    _N3_    24     1.38516   113.34656    41.93171
   28    27 S   H    _HN3    25     1.01524   118.92797    -0.59149
   29    24 S   S    _SG2    35     1.82959   111.82711   -69.02945
   30    27 S   CT   _CA3    26     1.45453   123.47651   175.08526
   31    30 S   HC   HA31    27     1.09520   109.27354    23.65469
   32    30 S   HC   HA32    28     1.09496   107.11102   140.67491
   33    29 S   CT   _C17    36     1.84471    99.88522   139.75486
   34    33 S   HC   _H3_    37     1.09796   105.56047    39.22968
   35    30 S   CO3  _C3_    29     1.52925   113.09612   -99.84195
   36    35 S   O2Z  _O31    30     1.26404   115.40709   -44.11342
   37    35 S   O2Z  _O32    31     1.26355   114.97900   136.81448
   38    33 S   CA   _C14    38     1.52236   111.29142   -78.33473
   39    33 S   CT   _C16    51     1.55468   109.74459   153.53056
   40    39 S   HC   _H29    52     1.09886   108.92552   -56.17269
   41    38 S   CA   _C9_    39     1.40598   122.29445   -61.60252
   42    41 S   HA   _H25    40     1.08694   120.72738     1.42629
   43    39 S   CA   _C13    53     1.51830   112.51362  -174.40374
   44    39 S   OH   _O18    64     1.42736   112.38682    60.13419
   45    44 S   HO   _H31    65     0.97316   106.95776   -53.68378
   46    41 S   CA   _C11    41     1.39653   121.01322  -178.30004
   47    46 S   HA   _H27    42     1.08650   119.07038   179.70725
   48    43 S   CA   _C7_    54     1.40308   121.98009   -97.46080
   49    48 S   HA   _H23    55     1.08716   120.63933    -1.02984
   50    46 S   CA   _C15    43     1.39450   119.15751    -0.69267
   51    48 S   CA   _C5_    56     1.39631   120.65587   178.61182
   52    51 S   HA   _H21    57     1.08631   119.88002  -179.96044
   53    50 S   CA   _C12    44     1.39507   121.19233     0.12511
   54    53 S   HA   _H28    45     1.08652   121.82733   179.47140
   55    50 S   NO2  _N15    48     1.45462   119.45774   179.56659
   56    55 S   ON   _O16    49     1.23843   117.53742   -31.15875
   57    55 S   ON   _O17    50     1.23878   117.48127   149.63257
   58    51 S   CA   _C4_    58     1.39294   120.12683    -0.08393
   59    58 S   HA   _H20    59     1.08610   120.04676  -179.98022
   60    38 S   CA   _C10    46     1.40655   119.23038   119.38973
   61    60 S   HA   _H26    47     1.08790   120.29586    -0.68271
   62    58 S   CA   _C6_    60     1.39280   119.89163    -0.06853
   63    62 S   HA   _H22    61     1.08628   119.99032  -179.87967
   64    43 S   CA   _C8_    62     1.40404   119.45258    80.85370
   65    64 S   HA   _H24    63     1.08755   120.30651     1.19058
  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
  15   7   2   1   1  13  12   5   8   4  11   3   1   8   3   8
   4   7   6   3   6   3   3   1   1   5   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    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    60    39    40    43    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    46    53    60    61    39    40    43    48    64    44    45  
   38    41    60    39    40    43    44  
   36    37  
   37  
    0  
   41    42    46    47    50    53    54    60    61    39    40    43    44  
   40    43    48    49    51    62    64    65    44    45    41    60  
   43    48    64    44    45  
   42    46    47    50    53    60    61    55  
   46    47    50    60  
   48    49    51    52    58    62    63    64    65    44    45  
   45    48    64  
    0  
   47    50    53    54    60    55    56    57  
   50    53    55  
   49    51    52    58    59    62    64    65  
   51    52    58    64  
   53    54    60    61    55    56    57  
   52    58    59    62    63    64  
   58    59    62  
   54    60    61    55    56    57  
   60    61    55  
   56    57    60  
   57  
    0  
   59    62    63    64    65  
   62    63    64  
   61  
    0  
   63    64    65  
   64    65  
   65  
    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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   47   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   56   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   57   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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    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    60   469.000  1.400
   41    42   367.000  1.080
   41    46   469.000  1.400
   46    47   367.000  1.080
   46    50   469.000  1.400
   50    53   469.000  1.400
   50    55   400.000  1.460
   53    54   367.000  1.080
   53    60   469.000  1.400
   60    61   367.000  1.080
   55    56   550.000  1.225
   55    57   550.000  1.225
   39    40   340.000  1.090
   39    43   317.000  1.510
   39    44   320.000  1.410
   43    48   469.000  1.400
   43    64   469.000  1.400
   48    49   367.000  1.080
   48    51   469.000  1.400
   51    52   367.000  1.080
   51    58   469.000  1.400
   58    59   367.000  1.080
   58    62   469.000  1.400
   62    63   367.000  1.080
   62    64   469.000  1.400
   64    65   367.000  1.080
   44    45   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    60    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    43    70.00000  112.17500
   33    39    44    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    46    63.00000  120.00000
   38    60    53    63.00000  120.00000
   38    60    61    35.00000  120.00000
   41    46    47    35.00000  120.00000
   41    46    50    63.00000  120.00000
   46    41    42    35.00000  120.00000
   46    50    53    63.00000  120.00000
   46    50    55    85.00000  120.00000
   50    46    47    35.00000  120.00000
   50    53    54    35.00000  120.00000
   50    53    60    63.00000  120.00000
   50    55    56    80.00000  117.50000
   50    55    57    80.00000  117.50000
   53    60    61    35.00000  120.00000
   60    38    41    63.00000  120.00000
   60    53    54    35.00000  120.00000
   55    50    53    85.00000  120.00000
   57    55    56    80.00000  125.30000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    43    48    70.00000  120.00000
   39    43    64    70.00000  120.00000
   39    44    45    55.00000  108.50000
   43    39    40    35.00000  109.50000
   43    48    49    35.00000  120.00000
   43    48    51    63.00000  120.00000
   43    64    62    63.00000  120.00000
   43    64    65    35.00000  120.00000
   48    51    52    35.00000  120.00000
   48    51    58    63.00000  120.00000
   51    48    49    35.00000  120.00000
   51    58    59    35.00000  120.00000
   51    58    62    63.00000  120.00000
   58    51    52    35.00000  120.00000
   58    62    63    35.00000  120.00000
   58    62    64    63.00000  120.00000
   62    58    59    35.00000  120.00000
   62    64    65    35.00000  120.00000
   64    43    48    63.00000  120.00000
   64    62    63    35.00000  120.00000
   44    39    40    35.00000  109.50000
   44    39    43    90.00000  112.51600
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    60  -0.16000  1.0 1.0
   29    33    38    60  -0.03200 -1.0 2.0
   29    33    38    60   0.04500  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
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    46   3.62500 -1.0 2.0
   33    38    60    53   3.62500 -1.0 2.0
   33    38    60    61   3.62500 -1.0 2.0
   33    39    43    48   0.04150 -1.0 2.0
   33    39    43    64   0.04150 -1.0 2.0
   33    39    44    45  -0.11600  1.0 1.0
   33    39    44    45  -0.09450 -1.0 2.0
   33    39    44    45   0.21250  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    60   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    43   0.43200  1.0 3.0
   34    33    39    44   0.23400  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    43  -0.94300  1.0 1.0
   38    33    39    43   1.32550 -1.0 2.0
   38    33    39    43  -0.07100  1.0 3.0
   38    33    39    44   1.13150  1.0 1.0
   38    33    39    44  -1.01400 -1.0 2.0
   38    41    46    47   3.62500 -1.0 2.0
   38    41    46    50   3.62500 -1.0 2.0
   41    38    60    53   3.62500 -1.0 2.0
   41    38    60    61   3.62500 -1.0 2.0
   41    46   -50    53   3.62500 -1.0 2.0
   41    46    50    55   3.62500 -1.0 2.0
   42    41    46    47   3.62500 -1.0 2.0
   42    41    46    50   3.62500 -1.0 2.0
   46    50    53    54   3.62500 -1.0 2.0
   46    50    53    60   3.62500 -1.0 2.0
   46    50    55    56   0.69950 -1.0 2.0
   46    50    55    57   0.69950 -1.0 2.0
   47    46    50    53   3.62500 -1.0 2.0
   47    46    50    55   3.62500 -1.0 2.0
   50    53   -60    38   3.62500 -1.0 2.0
   50    53    60    61   3.62500 -1.0 2.0
   53    50    55    56   0.69950 -1.0 2.0
   53    50    55    57   0.69950 -1.0 2.0
   54    53    60    38   3.62500 -1.0 2.0
   54    53    60    61   3.62500 -1.0 2.0
   60    38    41    42   3.62500 -1.0 2.0
   60    38   -41    46   3.62500 -1.0 2.0
   55    50    53    54   3.62500 -1.0 2.0
   55    50    53    60   3.62500 -1.0 2.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33    38    60   0.04150 -1.0 2.0
   39    43    48    49   3.62500 -1.0 2.0
   39    43    48    51   3.62500 -1.0 2.0
   39    43    64    62   3.62500 -1.0 2.0
   39    43    64    65   3.62500 -1.0 2.0
   40    39    43    48   0.00000  1.0 1.0
   40    39    43    64   0.00000  1.0 1.0
   40    39    44    45   0.19450  1.0 3.0
   43    39    44    45   0.31900  1.0 1.0
   43    39    44    45  -0.11800 -1.0 2.0
   43    39    44    45   0.38750  1.0 3.0
   43    48    51    52   3.62500 -1.0 2.0
   43    48    51    58   3.62500 -1.0 2.0
   48    43    64    62   3.62500 -1.0 2.0
   48    43    64    65   3.62500 -1.0 2.0
   48    51    58    59   3.62500 -1.0 2.0
   48    51   -58    62   3.62500 -1.0 2.0
   49    48    51    52   3.62500 -1.0 2.0
   49    48    51    58   3.62500 -1.0 2.0
   51    58    62    63   3.62500 -1.0 2.0
   51    58    62    64   3.62500 -1.0 2.0
   52    51    58    59   3.62500 -1.0 2.0
   52    51    58    62   3.62500 -1.0 2.0
   58    62   -64    43   3.62500 -1.0 2.0
   58    62    64    65   3.62500 -1.0 2.0
   59    58    62    63   3.62500 -1.0 2.0
   59    58    62    64   3.62500 -1.0 2.0
   63    62    64    43   3.62500 -1.0 2.0
   63    62    64    65   3.62500 -1.0 2.0
   64    43    48    49   3.62500 -1.0 2.0
   64    43   -48    51   3.62500 -1.0 2.0
   44    39    43    48   0.14300 -1.0 2.0
   44    39    43    48   0.00300  1.0 3.0
   44    39    43    64   0.14300 -1.0 2.0
   44    39    43    64   0.00300  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
   37    30    35    36  10.50000 -1.0 2.0
   41    60    38    33   4.00000 -1.0 2.0
   46    42    41    38   1.10000 -1.0 2.0
   50    47    46    41   1.10000 -1.0 2.0
   53    55    50    46   4.00000 -1.0 2.0
   60    54    53    50   1.10000 -1.0 2.0
   53    61    60    38   1.10000 -1.0 2.0
   57    50    55    56  10.50000 -1.0 2.0
   48    64    43    39   4.00000 -1.0 2.0
   51    49    48    43   1.10000 -1.0 2.0
   58    52    51    48   1.10000 -1.0 2.0
   62    59    58    51   1.10000 -1.0 2.0
   64    63    62    58   1.10000 -1.0 2.0
   62    65    64    43   1.10000 -1.0 2.0
END
