* LIGAND DATABASE FILE (OPLS2005)
*
001      69    73    128    218     380
    1     0 S   NP   _N1_     1    29.19280    97.90576   -18.73000
    2     1 S   H    _HN1     2     1.02783    81.02335   -96.60016
    3     1 S   H    _H1_     3     1.02954    72.37233    16.01036
    4     1 S   H    _H2_     4     1.02840    54.10977   143.54370
    5     1 S   CT   _CA1     5     1.50122   163.52241   118.54036
    6     5 S   HC   _HA1     6     1.09564   105.24993    80.61553
    7     5 S   CO3  _C1_     7     1.53797   112.36464   -39.75257
    8     7 S   O2Z  _O11     8     1.26368   114.96097   -42.86489
    9     7 S   O2Z  _O12     9     1.26218   114.94600   136.28765
   10     5 S   CT   _CB1    10     1.53068   107.45142  -161.28049
   11    10 S   HC   HB11    11     1.09826   109.48607   -48.75239
   12    10 S   HC   HB12    12     1.09821   110.37058    67.85188
   13    10 S   CT   _CG1    13     1.53024   112.65541  -169.75047
   14    13 S   HC   HG11    14     1.09557   110.57168   -61.63475
   15    13 S   HC   HG12    15     1.09644   109.96799    57.54474
   16    13 S   C    _CD1    16     1.51812   112.13595   177.80697
   17    16 S   O    _OE1    17     1.22742   123.22901    -2.82902
   18    16 S   N    _N2_    18     1.38569   111.80066   177.02863
   19    18 S   H    _HN2    19     1.01610   118.99404     4.70981
   20    18 S   CT1  _CA2    20     1.45691   122.78254   177.56008
   21    20 S   HC   _HA2    21     1.09627   110.03491    14.42021
   22    20 S   C    _C2_    22     1.52583   104.23571  -103.17255
   23    22 S   O    _O2_    23     1.23039   122.28525   -74.28651
   24    20 S   CT   _CB2    32     1.53138   112.38071   137.85356
   25    24 S   HC   HB21    33     1.09521   111.80386    51.32364
   26    24 S   HC   HB22    34     1.09596   109.25773   169.23184
   27    22 S   N    _N3_    24     1.38354   113.13428   101.71384
   28    27 S   H    _HN3    25     1.01675   120.41740     0.41069
   29    24 S   S    _SG2    35     1.82852   111.93000   -72.90473
   30    27 S   CT   _CA3    26     1.45357   122.43460  -178.19246
   31    30 S   HC   HA31    27     1.09578   107.72454   -57.20368
   32    30 S   HC   HA32    28     1.09578   107.67418    59.10693
   33    29 S   CT   _C22    36     1.84966   100.24141    96.19736
   34    33 S   HC   _H3_    37     1.09594   108.65946   -38.38032
   35    30 S   CO3  _C3_    29     1.52897   114.36816  -179.18195
   36    35 S   O2Z  _O31    30     1.26338   116.07589    -1.97249
   37    35 S   O2Z  _O32    31     1.26439   114.39351   178.07258
   38    33 S   CA   _C19    38     1.52279   108.90418  -155.34112
   39    38 S   CA   _C11    39     1.40090   118.69481    82.64124
   40    39 S   HA   _H30    40     1.08828   119.15026     1.17586
   41    38 S   CA   _C18    61     1.41290   121.47652   -95.60656
   42    39 S   CA   _C14    41     1.39552   121.24609  -178.42778
   43    41 S   CM   _C20    62     1.47722   117.68221    -1.57682
   44    43 S   HC   _H31    63     1.08253   119.83497   166.61514
   45    42 S   CA   _C9_    42     1.40071   120.23501  -179.92338
   46    45 S   HA   _H28    43     1.08838   120.59552     0.17583
   47    42 S   CR3  _C17    59     1.41363   119.69585     0.12033
   48    43 S   CM   _C21    64     1.33950   121.52843   -15.18940
   49    48 S   HC   _H32    65     1.08623   119.35688  -177.45301
   50    45 S   CA   _C7_    44     1.39316   120.87636   179.96044
   51    50 S   HA   _H26    45     1.08791   118.73212  -179.80021
   52    55 S   CR3  _C16    60     1.41667   119.32771    -0.03956
   53    33 S   CT   _C23    66     1.54284   110.43506    80.69540
   54    53 S   HC   _H34    67     1.09576   110.58119   -37.60740
   55    50 S   CA   _C12    46     1.39774   120.51242     0.04846
   56    53 S   OH   _O21    68     1.43037   108.80464  -153.48923
   57    56 S   HO   _H35    69     0.97249   107.79801  -177.07752
   58    55 S   CA   _C5_    47     1.40262   120.93819  -180.00000
   59    58 S   HA   _H24    48     1.08799   120.60353    -0.03956
   60    58 S   CA   _C4_    49     1.39254   120.58493   179.92338
   61    60 S   HA   _H23    50     1.08626   119.99469  -179.98022
   62    60 S   CA   _C6_    51     1.39250   119.99946    -0.04846
   63    62 S   HA   _H25    52     1.08796   118.81947  -179.92087
   64    62 S   CA   _C13    53     1.40302   120.57376     0.03426
   65    64 S   CA   _C8_    54     1.39454   121.14163  -179.81337
   66    65 S   HA   _H27    55     1.08815   120.66051     0.11191
   67    65 S   CA   _C10    56     1.39746   120.67942   179.96044
   68    67 S   HA   _H29    57     1.08664   116.42100  -179.49876
   69    67 S   CA   _C15    58     1.41458   122.30374     0.21850
  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   4  12  10   9   4   8   4  10   6
   3   7   3  11   3   2   8   1   1   6   3   5   3   5   2   5
   4   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    53    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    48    53    54    56  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    42    69    41    43    48    49    53    54    56    57  
   38    39    41    48    53    54    56  
   36    37  
   37  
    0  
   39    40    42    45    67    69    47    41    43    44    48    53    54    56  
   40    42    45    46    50    69    47    52    41    43    53  
   42    45    47    41  
   43    44    48    49    53    42    47    52    65    67    68    69  
   45    46    50    51    55    64    67    69    47    52  
   44    48    49    53    54    56    47    67    69  
   48    49    53    69  
   46    50    51    55    58    69    47    52  
   50    51    55    47  
   52    50    55    58    62    64    65    67    68    69  
   49    53    54    56    57    69  
   53    54    56  
   51    55    58    59    60    64    52  
   55    58    52  
   55    58    59    60    62    63    64    65    66    67    69  
   54    56    57  
   56    57  
   58    59    60    61    62    64    65    69  
   57  
    0  
   59    60    61    62    63    64  
   60    61    62  
   61    62    63    64    65  
   62    63    64  
   63    64    65    66    67  
   64    65  
   65    66    67    68    69  
   66    67    68    69  
   67    68    69  
   68    69  
   69  
    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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   40   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   41   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   43   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   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   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   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   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   57   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   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  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   68   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   69   3.5500   0.0700   0.000000   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    53   268.000  1.529
   38    39   469.000  1.400
   38    41   469.000  1.400
   39    40   367.000  1.080
   39    42   469.000  1.400
   42    45   469.000  1.400
   42    47   490.000  1.398
   45    46   367.000  1.080
   45    50   469.000  1.400
   50    51   367.000  1.080
   50    55   469.000  1.400
   55    58   469.000  1.400
   55    52   490.000  1.398
   58    59   367.000  1.080
   58    60   469.000  1.400
   60    61   367.000  1.080
   60    62   469.000  1.400
   62    63   367.000  1.080
   62    64   469.000  1.400
   64    65   469.000  1.400
   64    52   490.000  1.398
   65    66   367.000  1.080
   65    67   469.000  1.400
   67    68   367.000  1.080
   67    69   469.000  1.400
   69    47   490.000  1.398
   69    41   469.000  1.400
   47    52   490.000  1.398
   41    43   320.000  1.460
   43    44   340.000  1.080
   43    48   549.000  1.340
   48    49   340.000  1.080
   48    53   317.000  1.510
   53    54   340.000  1.090
   53    56   320.000  1.410
   56    57   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    53    75.00000  111.63000
   33    38    39    70.00000  120.00000
   33    38    41    70.00000  120.00000
   33    53    48    70.00000  112.02700
   33    53    54    37.50000  110.70000
   33    53    56    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    39    40    35.00000  120.00000
   38    39    42    63.00000  120.00000
   38    41    69    63.00000  120.00000
   38    41    43    60.00000  120.93500
   39    42    45    63.00000  120.00000
   39    42    47    70.00000  112.88000
   42    39    40    35.00000  120.00000
   42    45    46    35.00000  120.00000
   42    45    50    63.00000  120.00000
   42    47    69    60.00000  130.80000
   42    47    52    60.00000  130.80000
   45    50    51    35.00000  120.00000
   45    50    55    63.00000  120.00000
   50    45    46    35.00000  120.00000
   50    55    58    63.00000  120.00000
   50    55    52    70.00000  112.88000
   55    50    51    35.00000  120.00000
   55    58    59    35.00000  120.00000
   55    58    60    63.00000  120.00000
   55    52    64    60.00000  130.80000
   55    52    47    60.00000  130.80000
   58    60    61    35.00000  120.00000
   58    60    62    63.00000  120.00000
   60    58    59    35.00000  120.00000
   60    62    63    35.00000  120.00000
   60    62    64    63.00000  120.00000
   62    60    61    35.00000  120.00000
   62    64    65    63.00000  120.00000
   62    64    52    70.00000  112.88000
   64    62    63    35.00000  120.00000
   64    65    66    35.00000  120.00000
   64    65    67    63.00000  120.00000
   64    52    47    60.00000  130.80000
   65    67    68    35.00000  120.00000
   65    67    69    63.00000  120.00000
   67    65    66    35.00000  120.00000
   67    69    47    70.00000  112.88000
   67    69    41    63.00000  120.00000
   69    67    68    35.00000  120.00000
   69    47    52    60.00000  130.80000
   69    41    43    60.00000  120.93500
   47    42    45    70.00000  112.88000
   52    55    58    70.00000  112.88000
   52    64    65    70.00000  112.88000
   41    38    39    63.00000  120.00000
   41    69    47    70.00000  112.88000
   41    43    44    40.00000  117.26300
   41    43    48    60.00000  123.20500
   43    48    49    35.00000  120.00000
   43    48    53    70.00000  124.00000
   48    43    44    35.00000  120.00000
   48    53    54    35.00000  109.50000
   48    53    56    90.00000  110.39200
   53    33    34    37.50000  110.70000
   53    33    38    70.00000  112.17500
   53    48    49    35.00000  117.00000
   53    56    57    55.00000  108.50000
   56    53    54    35.00000  109.50000
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    53   0.01700  1.0 1.0
   24    29    33    53  -0.23550 -1.0 2.0
   24    29    33    53   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    39  -0.16000  1.0 1.0
   29    33    38    39  -0.03200 -1.0 2.0
   29    33    38    39   0.04500  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    53    48   0.56750  1.0 1.0
   29    33    53    48  -0.07550 -1.0 2.0
   29    33    53    48   0.20000  1.0 3.0
   29    33    53    54   0.15000  1.0 3.0
   29    33    53    56   0.56750  1.0 1.0
   29    33    53    56  -0.07550 -1.0 2.0
   29    33    53    56   0.20000  1.0 3.0
   33    38    39    40   3.62500 -1.0 2.0
   33    38    39    42   3.62500 -1.0 2.0
   33    38    41    69   3.62500 -1.0 2.0
   33    38    41    43   3.62500 -1.0 2.0
   33    53    56    57  -0.11600  1.0 1.0
   33    53    56    57  -0.09450 -1.0 2.0
   33    53    56    57   0.21250  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    53    48   0.15000  1.0 3.0
   34    33    53    54   0.15000  1.0 3.0
   34    33    53    56   0.23400  1.0 3.0
   38    33    53    48   0.21200  1.0 1.0
   38    33    53    48   0.16900 -1.0 2.0
   38    33    53    48  -1.15100  1.0 3.0
   38    33    53    54   0.43200  1.0 3.0
   38    33    53    56   1.13150  1.0 1.0
   38    33    53    56  -1.01400 -1.0 2.0
   38    39    42    45   3.62500 -1.0 2.0
   38    39    42    47   3.62500 -1.0 2.0
   38    41    43    44   0.56550  1.0 3.0
   38    41   -43    48   0.15800  1.0 1.0
   38    41   -43    48   1.85350 -1.0 2.0
   38    41   -43    48  -0.48700  1.0 3.0
   39    38    41    69   3.62500 -1.0 2.0
   39    38    41    43   3.62500 -1.0 2.0
   39    42    45    46   3.62500 -1.0 2.0
   39    42    45    50   3.62500 -1.0 2.0
   39    42   -47    69   3.62500 -1.0 2.0
   39    42    47    52   3.62500 -1.0 2.0
   40    39    42    45   3.62500 -1.0 2.0
   40    39    42    47   3.62500 -1.0 2.0
   42    45    50    51   3.62500 -1.0 2.0
   42    45    50    55   3.62500 -1.0 2.0
   42    47   -52    55   3.62500 -1.0 2.0
   42    47    52    64   3.62500 -1.0 2.0
   45    42    47    69   3.62500 -1.0 2.0
   45    42    47    52   3.62500 -1.0 2.0
   45    50    55    58   3.62500 -1.0 2.0
   45    50   -55    52   3.62500 -1.0 2.0
   46    45    50    51   3.62500 -1.0 2.0
   46    45    50    55   3.62500 -1.0 2.0
   50    55    58    59   3.62500 -1.0 2.0
   50    55    58    60   3.62500 -1.0 2.0
   50    55    52    64   3.62500 -1.0 2.0
   50    55    52    47   3.62500 -1.0 2.0
   51    50    55    58   3.62500 -1.0 2.0
   51    50    55    52   3.62500 -1.0 2.0
   55    58    60    61   3.62500 -1.0 2.0
   55    58    60    62   3.62500 -1.0 2.0
   58    55    52    64   3.62500 -1.0 2.0
   58    55    52    47   3.62500 -1.0 2.0
   58    60    62    63   3.62500 -1.0 2.0
   58    60   -62    64   3.62500 -1.0 2.0
   59    58    60    61   3.62500 -1.0 2.0
   59    58    60    62   3.62500 -1.0 2.0
   60    62    64    65   3.62500 -1.0 2.0
   60    62    64    52   3.62500 -1.0 2.0
   61    60    62    63   3.62500 -1.0 2.0
   61    60    62    64   3.62500 -1.0 2.0
   62    64    65    66   3.62500 -1.0 2.0
   62    64    65    67   3.62500 -1.0 2.0
   62    64   -52    55   3.62500 -1.0 2.0
   62    64    52    47   3.62500 -1.0 2.0
   63    62    64    65   3.62500 -1.0 2.0
   63    62    64    52   3.62500 -1.0 2.0
   64    65    67    68   3.62500 -1.0 2.0
   64    65    67    69   3.62500 -1.0 2.0
   65    64    52    55   3.62500 -1.0 2.0
   65    64    52    47   3.62500 -1.0 2.0
   65    67   -69    47   3.62500 -1.0 2.0
   65    67    69    41   3.62500 -1.0 2.0
   66    65    67    68   3.62500 -1.0 2.0
   66    65    67    69   3.62500 -1.0 2.0
   67    69    47    42   3.62500 -1.0 2.0
   67    69    47    52   3.62500 -1.0 2.0
   67    69    41    38   3.62500 -1.0 2.0
   67    69    41    43   3.62500 -1.0 2.0
   68    67    69    47   3.62500 -1.0 2.0
   68    67    69    41   3.62500 -1.0 2.0
   69    47    52    55   3.62500 -1.0 2.0
   69    47   -52    64   3.62500 -1.0 2.0
   69    41    43    44   0.56550  1.0 3.0
   69    41    43    48   0.15800  1.0 1.0
   69    41    43    48   1.85350 -1.0 2.0
   69    41    43    48  -0.48700  1.0 3.0
   47    42    45    46   3.62500 -1.0 2.0
   47    42   -45    50   3.62500 -1.0 2.0
   47    69   -41    38   3.62500 -1.0 2.0
   47    69    41    43   3.62500 -1.0 2.0
   52    55    58    59   3.62500 -1.0 2.0
   52    55   -58    60   3.62500 -1.0 2.0
   52    64    65    66   3.62500 -1.0 2.0
   52    64   -65    67   3.62500 -1.0 2.0
   41    38    39    40   3.62500 -1.0 2.0
   41    38    39    42   3.62500 -1.0 2.0
   41    69   -47    42   3.62500 -1.0 2.0
   41    69    47    52   3.62500 -1.0 2.0
   41    43    48    49   7.00000 -1.0 2.0
   41    43    48    53   7.00000 -1.0 2.0
   43    48   -53    33   0.09850  1.0 1.0
   43    48   -53    33   0.15250 -1.0 2.0
   43    48   -53    33  -0.50650  1.0 3.0
   43    48    53    54   0.00000  1.0 1.0
   43    48    53    56   0.67800  1.0 1.0
   43    48    53    56   0.47050 -1.0 2.0
   43    48    53    56  -0.62500  1.0 3.0
   44    43    48    49   7.00000 -1.0 2.0
   44    43    48    53   7.00000 -1.0 2.0
   48    53    56    57  -0.07800  1.0 1.0
   48    53    56    57  -0.21500 -1.0 2.0
   48    53    56    57  -0.03150  1.0 3.0
   49    48    53    33   0.00000  1.0 1.0
   49    48    53    54   0.33100  1.0 3.0
   49    48    53    56   0.00000  1.0 1.0
   53    33    38    39   0.04150 -1.0 2.0
   53    33   -38    41   0.04150 -1.0 2.0
   54    53    56    57   0.19450  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
   39    41    38    33   4.00000 -1.0 2.0
   42    40    39    38   1.10000 -1.0 2.0
   45    47    42    39   4.00000 -1.0 2.0
   50    46    45    42   1.10000 -1.0 2.0
   55    51    50    45   1.10000 -1.0 2.0
   58    52    55    50   4.00000 -1.0 2.0
   60    59    58    55   1.10000 -1.0 2.0
   62    61    60    58   1.10000 -1.0 2.0
   64    63    62    60   1.10000 -1.0 2.0
   65    52    64    62   4.00000 -1.0 2.0
   67    66    65    64   1.10000 -1.0 2.0
   69    68    67    65   1.10000 -1.0 2.0
   47    41    69    67   4.00000 -1.0 2.0
   69    52    47    42   4.00000 -1.0 2.0
   64    47    52    55   4.00000 -1.0 2.0
   69    43    41    38   4.00000 -1.0 2.0
   41    44    43    48   1.10000 -1.0 2.0
   53    49    48    43   1.10000 -1.0 2.0
END
