* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    123    202     365
    1     0 S   NP   _N1_     1    28.04295    97.80504   -23.22162
    2     1 S   H    _HN1     2     1.02957    67.44328     6.35700
    3     1 S   H    _H1_     3     1.02836    42.18833   165.00282
    4     1 S   H    _H2_     4     1.02777   106.99526   -96.89040
    5     1 S   CT   _CA1     5     1.50134   138.62993   102.05741
    6     5 S   HC   _HA1     6     1.09576   105.20725    98.95937
    7     5 S   CO3  _C1_     7     1.53771   112.32781   -21.20919
    8     7 S   O2Z  _O11     8     1.26364   114.99810   -44.72796
    9     7 S   O2Z  _O12     9     1.26231   114.91908   134.30182
   10     5 S   CT   _CB1    10     1.53088   107.41385  -143.16908
   11    10 S   HC   HB11    11     1.09829   109.28921   -50.64539
   12    10 S   HC   HB12    12     1.09815   110.44781    65.88791
   13    10 S   CT   _CG1    13     1.53035   112.70158  -171.71549
   14    13 S   HC   HG11    14     1.09592   110.51315   -65.00973
   15    13 S   HC   HG12    15     1.09658   109.90415    54.20704
   16    13 S   C    _CD1    16     1.51850   112.25215   174.54231
   17    16 S   O    _OE1    17     1.22764   123.26199     1.51375
   18    16 S   N    _N2_    18     1.38569   111.78789  -178.47351
   19    18 S   H    _HN2    19     1.01571   119.03896     4.19834
   20    18 S   CT1  _CA2    20     1.45781   122.77619   177.41533
   21    20 S   HC   _HA2    21     1.09746   108.86273    24.03218
   22    20 S   C    _C2_    22     1.52857   107.08740   -92.90767
   23    22 S   O    _O2_    23     1.22968   122.96649   -30.67566
   24    20 S   CT   _CB2    32     1.53057   112.22244   147.15427
   25    24 S   HC   HB21    33     1.09572   110.78965    50.56924
   26    24 S   HC   HB22    34     1.09478   109.94720   169.71472
   27    22 S   N    _N3_    24     1.38559   112.56492   151.89089
   28    27 S   H    _HN3    25     1.01614   120.30810    -0.87581
   29    24 S   S    _SG2    35     1.82520   110.76481   -70.35263
   30    27 S   CT   _CA3    26     1.45360   122.44471   179.11574
   31    30 S   HC   HA31    27     1.09556   107.57020   -62.77284
   32    30 S   HC   HA32    28     1.09573   107.80288    53.50987
   33    29 S   CT   _C22    36     1.84572    99.18235  -173.58030
   34    33 S   HC   _H3_    37     1.09459   109.66673    21.27162
   35    30 S   CO3  _C3_    29     1.52882   114.44206   175.74844
   36    35 S   O2Z  _O31    30     1.26405   116.11133     8.03270
   37    35 S   O2Z  _O32    31     1.26404   114.47739  -172.30022
   38    33 S   CM   _C18    38     1.50937   107.41211   -94.28642
   39    38 S   HC   _H34    39     1.08900   116.66496    74.41784
   40    38 S   CMA  _C19    40     1.34724   124.29279  -105.81886
   41    40 S   OM   _O20    41     1.25878   131.24524  -180.00000
   42    40 S   CM   _C16    42     1.45832   116.97736     1.14808
   43    42 S   HC   _H32    43     1.08929   119.06763   171.08756
   44    42 S   CM   _C17    44     1.34309   123.01256   -10.13570
   45    44 S   HC   _H33    45     1.08535   117.55052  -177.77340
   46    33 S   CM   _C20    46     1.53698   108.80339   141.16176
   47    46 S   CM   _C21    47     1.36499   123.49459   -83.51486
   48    47 S   CA   _C12    48     1.48551   120.03736    -0.57607
   49    47 S   CA   _C13    60     1.48502   120.93969  -179.37442
   50    48 S   CA   _C4_    49     1.40226   120.47478    94.67019
   51    50 S   HA   _H24    50     1.08738   120.61321     0.41496
   52    49 S   CA   _C6_    61     1.40246   120.20250    88.32224
   53    52 S   HA   _H26    62     1.08746   120.54294    -0.49456
   54    50 S   CA   _C8_    51     1.39545   120.28450  -178.56346
   55    54 S   HA   _H28    52     1.08612   119.57119   179.17909
   56    52 S   CA   _C10    63     1.39559   120.24115   179.66545
   57    56 S   HA   _H30    64     1.08596   119.47969   179.87489
   58    54 S   CA   _C14    53     1.39288   119.53252    -0.67202
   59    56 S   CA   _C15    65     1.39333   119.52031    -0.11869
   60    58 S   CA   _C9_    54     1.39177   120.85900    -0.79130
   61    60 S   HA   _H29    55     1.08615   120.47738  -179.61285
   62    58 S   OH   _O21    58     1.36605   121.04749   179.04941
   63    62 S   HO   _H36    59     0.97685   108.63886   -11.15858
   64    59 S   CA   _C11    66     1.39234   120.86460    -0.01978
   65    64 S   HA   _H31    67     1.08622   120.49408  -179.97202
   66    59 S   OH   _O22    70     1.36644   121.00953   179.97202
   67    66 S   HO   _H37    71     0.97239   108.57650     0.03426
   68    48 S   CA   _C5_    56     1.40273   120.08973   -85.69618
   69    68 S   HA   _H25    57     1.08743   120.57327    -0.31652
   70    49 S   CA   _C7_    68     1.40218   120.23182   -92.27291
   71    70 S   HA   _H27    69     1.08731   120.60646     0.54965
  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   8   5   4   3
  12   6   2   1   1   8   4   6   3   5   3   5   2   7  14  12
  11   8   4   8   4   7   3   7   3   6   6   5   3   2   1   5
   3   2   1   1   1   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    46    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    46    47  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    44    45    46    47    48    49  
   38    39    40    44    46    47  
   36    37  
   37  
    0  
   39    40    41    42    43    44    46    47  
   40    41    42    46  
   41    42    43    44    45    46  
   42    43    44  
   43    44    45    46    47  
   44    45    46  
   45    46    47    48    49  
   46    47  
   47    48    50    68    49    52    70  
   48    50    51    54    60    68    69    49    52    53    56    64    70    71  
   50    51    54    55    58    60    61    68    69    49    52    70  
   52    53    56    57    59    64    65    70    71    50    68  
   51    54    55    58    60    68    69    62  
   54    55    58    68  
   53    56    57    59    64    70    71    66  
   56    57    59    70  
   55    58    60    61    68    62    63  
   58    60    62  
   57    59    64    65    70    66    67  
   59    64    66  
   60    61    68    69    62    63  
   64    65    70    71    66    67  
   61    68    69    62    63  
   68    69    62  
   63    68  
    0  
   65    70    71    66    67  
   70    71    66  
   67    70  
    0  
   69  
    0  
   71  
    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   0.107500   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   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   47   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   48   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   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  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   59   3.5500   0.0700   0.150000   2.0020   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   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   63   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   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
   66   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   67   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   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   2.0020   1.7750   0.001000000  -0.843144165
   71   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    46   317.000  1.510
   38    39   340.000  1.080
   38    40   465.000  1.376
   40    41   745.000  1.250
   40    42   465.000  1.376
   42    43   340.000  1.080
   42    44   549.000  1.340
   44    45   340.000  1.080
   44    46   380.000  1.444
   46    47   549.000  1.340
   47    48   320.000  1.460
   47    49   320.000  1.460
   48    50   469.000  1.400
   48    68   469.000  1.400
   50    51   367.000  1.080
   50    54   469.000  1.400
   54    55   367.000  1.080
   54    58   469.000  1.400
   58    60   469.000  1.400
   58    62   450.000  1.364
   60    61   367.000  1.080
   60    68   469.000  1.400
   68    69   367.000  1.080
   62    63   553.000  0.945
   49    52   469.000  1.400
   49    70   469.000  1.400
   52    53   367.000  1.080
   52    56   469.000  1.400
   56    57   367.000  1.080
   56    59   469.000  1.400
   59    64   469.000  1.400
   59    66   450.000  1.364
   64    65   367.000  1.080
   64    70   469.000  1.400
   70    71   367.000  1.080
   66    67   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    75.00000  112.20000
   29    33    46    75.00000  112.20000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    46    44    70.00000  124.00000
   33    46    47    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  137.10300
   38    40    42    70.00000  123.01800
   40    38    39    40.00000  120.50800
   40    42    43    40.00000  120.50800
   40    42    44    70.00000  117.34000
   42    40    41    65.00000  137.10300
   42    44    45    35.00000  120.00000
   42    44    46    70.00000  123.01800
   44    42    43    35.00000  120.00000
   44    46    47    70.00000  123.01800
   46    33    34    35.00000  109.50000
   46    33    38    70.00000  110.12100
   46    44    45    35.00000  120.00000
   46    47    48    60.00000  123.20500
   46    47    49    60.00000  123.20500
   47    48    50    60.00000  120.93500
   47    48    68    60.00000  120.93500
   47    49    52    60.00000  120.93500
   47    49    70    60.00000  120.93500
   48    50    51    35.00000  120.00000
   48    50    54    63.00000  120.00000
   48    68    60    63.00000  120.00000
   48    68    69    35.00000  120.00000
   50    54    55    35.00000  120.00000
   50    54    58    63.00000  120.00000
   54    50    51    35.00000  120.00000
   54    58    60    63.00000  120.00000
   54    58    62    70.00000  120.00000
   58    54    55    35.00000  120.00000
   58    60    61    35.00000  120.00000
   58    60    68    63.00000  120.00000
   58    62    63    35.00000  113.00000
   60    68    69    35.00000  120.00000
   68    48    50    63.00000  120.00000
   68    60    61    35.00000  120.00000
   62    58    60    70.00000  120.00000
   49    47    48    60.00000  122.92000
   49    52    53    35.00000  120.00000
   49    52    56    63.00000  120.00000
   49    70    64    63.00000  120.00000
   49    70    71    35.00000  120.00000
   52    56    57    35.00000  120.00000
   52    56    59    63.00000  120.00000
   56    52    53    35.00000  120.00000
   56    59    64    63.00000  120.00000
   56    59    66    70.00000  120.00000
   59    56    57    35.00000  120.00000
   59    64    65    35.00000  120.00000
   59    64    70    63.00000  120.00000
   59    66    67    35.00000  113.00000
   64    70    71    35.00000  120.00000
   70    49    52    63.00000  120.00000
   70    64    65    35.00000  120.00000
   66    59    64    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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    46  -0.62250  1.0 1.0
   24    29    33    46  -0.38450 -1.0 2.0
   24    29    33    46   0.81900  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    39   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    46    44   0.42700  1.0 1.0
   29    33    46    44  -0.70350 -1.0 2.0
   29    33    46    44  -0.43150  1.0 3.0
   29    33    46    47   0.42700  1.0 1.0
   29    33    46    47  -0.70350 -1.0 2.0
   29    33    46    47  -0.43150  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    42   7.00000 -1.0 2.0
   33    46    47    48   7.00000 -1.0 2.0
   33    46    47    49   7.00000 -1.0 2.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    46    44   0.00000  1.0 1.0
   34    33    46    47   0.00000  1.0 1.0
   38    33    46    44  -0.28300  1.0 1.0
   38    33    46    44   0.26700 -1.0 2.0
   38    33    46    44  -0.63300  1.0 3.0
   38    33    46    47  -0.28300  1.0 1.0
   38    33    46    47   0.26700 -1.0 2.0
   38    33    46    47  -0.63300  1.0 3.0
   38    40    42    43   7.00000 -1.0 2.0
   38    40   -42    44   7.00000 -1.0 2.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42    44    45   7.00000 -1.0 2.0
   40    42    44    46   7.00000 -1.0 2.0
   41    40    42    43   7.00000 -1.0 2.0
   41    40    42    44   7.00000 -1.0 2.0
   42    44   -46    33  -0.18600  1.0 3.0
   42    44    46    47   0.28850  1.0 1.0
   42    44    46    47   2.61350 -1.0 2.0
   42    44    46    47   0.78400  1.0 3.0
   43    42    44    45   7.00000 -1.0 2.0
   43    42    44    46   7.00000 -1.0 2.0
   44    46    47    48   7.00000 -1.0 2.0
   44    46    47    49   7.00000 -1.0 2.0
   45    44    46    33   0.00000  1.0 1.0
   45    44    46    47  -0.18600  1.0 3.0
   46    33    38    39   0.00000  1.0 1.0
   46    33   -38    40  -0.28300  1.0 1.0
   46    33   -38    40   0.26700 -1.0 2.0
   46    33   -38    40  -0.63300  1.0 3.0
   46    47    48    50   0.15800  1.0 1.0
   46    47    48    50   1.85350 -1.0 2.0
   46    47    48    50  -0.48700  1.0 3.0
   46    47    48    68   0.15800  1.0 1.0
   46    47    48    68   1.85350 -1.0 2.0
   46    47    48    68  -0.48700  1.0 3.0
   46    47    49    52   0.15800  1.0 1.0
   46    47    49    52   1.85350 -1.0 2.0
   46    47    49    52  -0.48700  1.0 3.0
   46    47    49    70   0.15800  1.0 1.0
   46    47    49    70   1.85350 -1.0 2.0
   46    47    49    70  -0.48700  1.0 3.0
   47    48    50    51   3.62500 -1.0 2.0
   47    48    50    54   3.62500 -1.0 2.0
   47    48    68    60   3.62500 -1.0 2.0
   47    48    68    69   3.62500 -1.0 2.0
   47    49    52    53   3.62500 -1.0 2.0
   47    49    52    56   3.62500 -1.0 2.0
   47    49    70    64   3.62500 -1.0 2.0
   47    49    70    71   3.62500 -1.0 2.0
   48    47    49    52  -0.01750  1.0 1.0
   48    47    49    52  -0.32000 -1.0 2.0
   48    47    49    52   0.00600  1.0 3.0
   48    47    49    70  -0.01750  1.0 1.0
   48    47    49    70  -0.32000 -1.0 2.0
   48    47    49    70   0.00600  1.0 3.0
   48    50    54    55   3.62500 -1.0 2.0
   48    50    54    58   3.62500 -1.0 2.0
   50    48    68    60   3.62500 -1.0 2.0
   50    48    68    69   3.62500 -1.0 2.0
   50    54   -58    60   3.62500 -1.0 2.0
   50    54    58    62   3.62500 -1.0 2.0
   51    50    54    55   3.62500 -1.0 2.0
   51    50    54    58   3.62500 -1.0 2.0
   54    58    60    61   3.62500 -1.0 2.0
   54    58    60    68   3.62500 -1.0 2.0
   54    58    62    63   0.84100 -1.0 2.0
   55    54    58    60   3.62500 -1.0 2.0
   55    54    58    62   3.62500 -1.0 2.0
   58    60   -68    48   3.62500 -1.0 2.0
   58    60    68    69   3.62500 -1.0 2.0
   60    58    62    63   0.84100 -1.0 2.0
   61    60    68    48   3.62500 -1.0 2.0
   61    60    68    69   3.62500 -1.0 2.0
   68    48    50    51   3.62500 -1.0 2.0
   68    48   -50    54   3.62500 -1.0 2.0
   62    58    60    61   3.62500 -1.0 2.0
   62    58    60    68   3.62500 -1.0 2.0
   49    47    48    50  -0.01750  1.0 1.0
   49    47    48    50  -0.32000 -1.0 2.0
   49    47    48    50   0.00600  1.0 3.0
   49    47    48    68  -0.01750  1.0 1.0
   49    47    48    68  -0.32000 -1.0 2.0
   49    47    48    68   0.00600  1.0 3.0
   49    52    56    57   3.62500 -1.0 2.0
   49    52    56    59   3.62500 -1.0 2.0
   52    49    70    64   3.62500 -1.0 2.0
   52    49    70    71   3.62500 -1.0 2.0
   52    56   -59    64   3.62500 -1.0 2.0
   52    56    59    66   3.62500 -1.0 2.0
   53    52    56    57   3.62500 -1.0 2.0
   53    52    56    59   3.62500 -1.0 2.0
   56    59    64    65   3.62500 -1.0 2.0
   56    59    64    70   3.62500 -1.0 2.0
   56    59    66    67   0.84100 -1.0 2.0
   57    56    59    64   3.62500 -1.0 2.0
   57    56    59    66   3.62500 -1.0 2.0
   59    64   -70    49   3.62500 -1.0 2.0
   59    64    70    71   3.62500 -1.0 2.0
   64    59    66    67   0.84100 -1.0 2.0
   65    64    70    49   3.62500 -1.0 2.0
   65    64    70    71   3.62500 -1.0 2.0
   70    49    52    53   3.62500 -1.0 2.0
   70    49   -52    56   3.62500 -1.0 2.0
   66    59    64    65   3.62500 -1.0 2.0
   66    59    64    70   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
   37    30    35    36  10.50000 -1.0 2.0
   33    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   40    43    42    44   1.10000 -1.0 2.0
   46    45    44    42   1.10000 -1.0 2.0
   33    44    46    47   1.10000 -1.0 2.0
   48    49    47    46   1.10000 -1.0 2.0
   50    68    48    47   4.00000 -1.0 2.0
   54    51    50    48   1.10000 -1.0 2.0
   58    55    54    50   1.10000 -1.0 2.0
   60    62    58    54   4.00000 -1.0 2.0
   68    61    60    58   1.10000 -1.0 2.0
   60    69    68    48   1.10000 -1.0 2.0
   52    70    49    47   4.00000 -1.0 2.0
   56    53    52    49   1.10000 -1.0 2.0
   59    57    56    52   1.10000 -1.0 2.0
   64    66    59    56   4.00000 -1.0 2.0
   70    65    64    59   1.10000 -1.0 2.0
   64    71    70    49   1.10000 -1.0 2.0
END
