* LIGAND DATABASE FILE (OPLS2005)
*
001      71    72    130    205     386
    1     0 S   NP   _N1_     1    31.72951   100.53949   -20.61558
    2     1 S   H    _HN1     2     1.03481   163.34166   -96.25572
    3     1 S   H    _H1_     3     1.02845    56.17184  -113.05153
    4     1 S   H    _H2_     4     1.02732    83.47871   130.98151
    5     1 S   CT   _CA1     5     1.50161    73.55344    16.83076
    6     5 S   HC   _HA1     6     1.09491   104.92724   132.23713
    7     5 S   CO3  _C1_     7     1.53833   113.22734    11.71965
    8     7 S   O2Z  _O11     8     1.26458   115.05084   -26.34368
    9     7 S   O2Z  _O12     9     1.26227   115.25853   153.19892
   10     5 S   CT   _CB1    10     1.53073   107.43105  -109.07984
   11    10 S   HC   HB11    11     1.09573   109.50258   -38.08717
   12    10 S   HC   HB12    12     1.09835   110.25646    77.44262
   13    10 S   CT   _CG1    13     1.53351   113.02414  -160.90018
   14    13 S   HC   HG11    14     1.09553   110.69538   -99.45021
   15    13 S   HC   HG12    15     1.09607   111.86290    19.91447
   16    13 S   C    _CD1    16     1.51527   109.88146   140.22108
   17    16 S   O    _OE1    17     1.22774   122.19254    99.07994
   18    16 S   N    _N2_    18     1.38400   112.27182   -78.42182
   19    18 S   H    _HN2    19     1.01987   118.89139    -4.67864
   20    18 S   CT1  _CA2    20     1.45962   123.44564   173.85350
   21    20 S   HC   _HA2    21     1.09667   108.73686    31.83606
   22    20 S   C    _C2_    22     1.53199   108.55268   -85.05123
   23    22 S   O    _O2_    23     1.23099   121.17106   150.62266
   24    20 S   CT   _CB2    32     1.53307   111.66326   155.40219
   25    24 S   HC   HB21    33     1.09323   109.20450    59.65515
   26    24 S   HC   HB22    34     1.09517   110.07610   177.85096
   27    22 S   N    _N3_    24     1.38394   114.26788   -36.84920
   28    27 S   H    _HN3    25     1.01608   119.25474     1.88429
   29    24 S   S    _SG2    35     1.82834   110.97903   -61.81638
   30    27 S   CT   _CA3    26     1.45252   123.36824  -177.20978
   31    30 S   HC   HA31    27     1.09559   108.27758   -43.48385
   32    30 S   HC   HA32    28     1.09540   107.21200    72.93818
   33    29 S   CT   _C11    36     1.84016   101.42139   162.40217
   34    33 S   HC   _H4_    37     1.09505   105.94397  -177.72024
   35    30 S   CO3  _C3_    29     1.53028   114.35089  -165.86229
   36    35 S   O2Z  _O31    30     1.26421   116.37352    -2.16139
   37    35 S   O2Z  _O32    31     1.26445   114.39980   177.55640
   38    33 S   CM   _C6_    38     1.50700   112.18187   -62.77524
   39    38 S   CM   _C7_    39     1.34356   121.87115   113.04543
   40    39 S   CO4  _C8_    40     1.49278   120.00137    -2.32195
   41    40 S   O    _O33    41     1.23351   118.79466  -164.37751
   42    39 S   NE   _N5_    57     1.37757   123.34084   178.30777
   43    42 S   H    _H14    58     1.01692   116.81074   174.72693
   44    40 S   CMA  _C9_    42     1.52234   119.35467    17.64413
   45    44 S   OM   _O36    43     1.26495   113.78542   164.87286
   46    42 S   CT1  _C15    59     1.45204   123.93640     4.75168
   47    46 S   HC   _H6_    60     1.09623   108.84863    88.37641
   48    33 S   CM   _C10    44     1.52069   110.30838    66.28848
   49    46 S   CT   _C4_    61     1.53393   108.81649   -31.21269
   50    49 S   HC   _H7_    62     1.09956   109.12786   -71.77682
   51    49 S   HC   _H8_    63     1.09765   109.72814   172.37321
   52    46 S   CO3  _C16    69     1.54078   107.86180  -156.44027
   53    52 S   O2Z  _O38    70     1.26364   116.39893   129.31131
   54    52 S   O2Z  _O37    71     1.26702   114.94825   -52.09196
   55    48 S   CT   _C12    45     1.53713   115.58798    68.11438
   56    55 S   HC   _H9_    46     1.09760   108.25715   -59.87764
   57    55 S   HC   _H10    47     1.09785   110.79415  -173.63980
   58    38 S   CT   _C5_    64     1.52401   118.74949   -72.96241
   59    58 S   HC   _H3_    65     1.09890   108.13848   -41.03977
   60    55 S   CT   _C13    48     1.53536   115.34878    62.88245
   61    60 S   HC   _H5_    49     1.09440   111.51009   -61.34451
   62    58 S   CO3  _C17    66     1.53619   112.33960    78.22975
   63    62 S   O2Z  _O40    67     1.26392   116.91477    53.38216
   64    62 S   O2Z  _O39    68     1.26596   114.44030  -126.73526
   65    60 S   CO3  _C14    50     1.53813   111.33626    61.92697
   66    65 S   O2Z  _O35    51     1.26421   114.97285    81.97337
   67    65 S   O2Z  _O34    52     1.26265   114.99442  -100.27502
   68    60 S   NP   _N4_    53     1.50542   107.17052  -174.91169
   69    68 S   H    _H11    54     1.02807   110.65508   176.72045
   70    68 S   H    _H12    55     1.02754   112.19653    55.89420
   71    68 S   H    _H13    56     1.02958   110.15252   -65.09882
  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
  16   6   2   1   1  17  14   9   4  11   4   6   2  10   7   8
  10   5   4   3   1   1  11   5   4   4   3   8   7   2   1   1
   6   2   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    48    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    44    48    55    58  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    44    45    48    55    56    57    60    42    49    58    59    62  
   38    39    44    48    55    58  
   36    37  
   37  
    0  
   39    40    41    44    48    55    42    43    46    49    50    51    58    59    62    63    64  
   40    41    44    45    48    42    43    46    47    49    58    59    62    52  
   41    44    45    48    55    42    43    46    58  
   44    45    48    42  
   43    46    47    49    50    51    58    52    53    54    44  
   46    47    49    52  
   45    48    55    56    57    60  
   48    55  
   47    49    50    51    58    59    62    52    53    54  
   49    50    51    58    52    53    54  
   55    56    57    60    61    65    68    58  
   50    51    58    59    62    63    64    52    53    54  
   51    58    59    62    52  
   58    59    62    52  
   53    54    58  
   54  
    0  
   56    57    60    61    65    66    67    68    69    70    71  
   57    60    61    65    68  
   60    61    65    68  
   59    62    63    64  
   62    63    64  
   61    65    66    67    68    69    70    71  
   65    66    67    68    69    70    71  
   63    64  
   64  
    0  
   66    67    68    69    70    71  
   67    68  
   68  
   69    70    71  
   70    71  
   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   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.018000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.2500   0.1700  -0.494200   1.8650   1.6500   0.051222218  -2.220205820
   43   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   45   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   46   3.5000   0.0660  -0.037500   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   48   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   64   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   65   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
   66   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   67   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   68   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
   69   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
   70   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
   71   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
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    48   317.000  1.510
   38    39   549.000  1.340
   38    58   317.000  1.510
   39    40   320.000  1.462
   39    42   425.000  1.378
   40    41   570.000  1.229
   40    44   270.000  1.476
   44    45   745.000  1.250
   44    48   465.000  1.376
   48    55   317.000  1.510
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    60   268.000  1.529
   60    61   340.000  1.090
   60    65   317.000  1.522
   60    68   367.000  1.471
   65    66   656.000  1.250
   65    67   656.000  1.250
   68    69   434.000  1.010
   68    70   434.000  1.010
   68    71   434.000  1.010
   42    43   434.000  1.010
   42    46   382.000  1.448
   46    47   340.000  1.090
   46    49   268.000  1.529
   46    52   317.000  1.522
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    58   268.000  1.529
   58    59   340.000  1.090
   58    62   317.000  1.522
   62    63   656.000  1.250
   62    64   656.000  1.250
   52    53   656.000  1.250
   52    54   656.000  1.250
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    48    75.00000  112.20000
   33    38    39    70.00000  124.00000
   33    38    58    65.00000  117.92700
   33    48    44    70.00000  124.00000
   33    48    55    65.00000  117.92700
   38    33    34    35.00000  109.50000
   38    39    40    65.00000  118.96000
   38    39    42    70.00000  124.03900
   38    58    49    70.00000  112.02700
   38    58    59    35.00000  109.50000
   38    58    62    65.00000  111.94000
   39    40    41    80.00000  123.72100
   39    40    44    65.00000  118.65900
   39    42    43    35.00000  114.50000
   39    42    46    50.00000  121.00000
   40    44    45    85.00000  116.28000
   40    44    48    65.00000  114.61000
   44    40    41    80.00000  120.81000
   44    48    55    70.00000  124.00000
   48    33    34    35.00000  109.50000
   48    33    38    70.00000  110.12100
   48    44    45    65.00000  137.10300
   48    55    56    35.00000  109.50000
   48    55    57    35.00000  109.50000
   48    55    60    70.00000  112.02700
   55    60    61    37.50000  110.70000
   55    60    65    70.00000  109.69300
   55    60    68    80.00000  111.20000
   57    55    56    33.00000  107.80000
   60    55    56    37.50000  110.70000
   60    55    57    37.50000  110.70000
   60    65    66    70.00000  117.00000
   60    65    67    70.00000  117.00000
   60    68    69    35.00000  109.50000
   60    68    70    35.00000  109.50000
   60    68    71    35.00000  109.50000
   65    60    61    35.00000  109.50000
   67    65    66    80.00000  126.00000
   68    60    61    35.00000  109.50000
   68    60    65    80.00000  109.26000
   70    68    69    35.00000  109.50000
   71    68    69    35.00000  109.50000
   71    68    70    35.00000  109.50000
   42    39    40    70.00000  117.92000
   42    46    47    35.00000  109.50000
   42    46    49    80.00000  111.61500
   42    46    52    63.00000  110.10000
   46    42    43    35.00000  112.50000
   46    49    50    37.50000  110.70000
   46    49    51    37.50000  110.70000
   46    49    58    58.35000  112.70000
   46    52    53    70.00000  117.00000
   46    52    54    70.00000  117.00000
   49    46    47    37.50000  110.70000
   49    58    59    37.50000  110.70000
   49    58    62    70.00000  109.69300
   51    49    50    33.00000  107.80000
   58    38    39    70.00000  124.00000
   58    49    50    37.50000  110.70000
   58    49    51    37.50000  110.70000
   58    62    63    70.00000  117.00000
   58    62    64    70.00000  117.00000
   62    58    59    35.00000  109.50000
   64    62    63    80.00000  126.00000
   52    46    47    35.00000  109.50000
   52    46    49    63.00000  111.10000
   54    52    53    80.00000  126.00000
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    48  -0.62250  1.0 1.0
   24    29    33    48  -0.38450 -1.0 2.0
   24    29    33    48   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   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    58   0.30250  1.0 1.0
   29    33    38    58  -0.14950 -1.0 2.0
   29    33    38    58   0.36900  1.0 3.0
   29    33    48    44   0.42700  1.0 1.0
   29    33    48    44  -0.70350 -1.0 2.0
   29    33    48    44  -0.43150  1.0 3.0
   29    33    48    55   0.30250  1.0 1.0
   29    33    48    55  -0.14950 -1.0 2.0
   29    33    48    55   0.36900  1.0 3.0
   33    38    39    40   7.00000 -1.0 2.0
   33    38    39    42   7.00000 -1.0 2.0
   33    38    58    49   0.46850  1.0 1.0
   33    38    58    49   0.08550 -1.0 2.0
   33    38    58    49   0.09800  1.0 3.0
   33    38    58    59   0.34800  1.0 3.0
   33    38    58    62   0.17250  1.0 1.0
   33    38    58    62  -0.04100 -1.0 2.0
   33    38    58    62  -0.33850  1.0 3.0
   33    48    55    56   0.34800  1.0 3.0
   33    48    55    57   0.34800  1.0 3.0
   33    48    55    60   0.46850  1.0 1.0
   33    48    55    60   0.08550 -1.0 2.0
   33    48    55    60   0.09800  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    58   0.34800  1.0 3.0
   34    33    48    44   0.00000  1.0 1.0
   34    33    48    55   0.34800  1.0 3.0
   38    33    48    44  -0.28300  1.0 1.0
   38    33    48    44   0.26700 -1.0 2.0
   38    33    48    44  -0.63300  1.0 3.0
   38    33    48    55   0.09700  1.0 1.0
   38    33    48    55   0.15600 -1.0 2.0
   38    33    48    55  -0.50800  1.0 3.0
   38    39    40    41   1.00000 -1.0 2.0
   38    39   -40    44  -1.18350  1.0 1.0
   38    39   -40    44   1.45950 -1.0 2.0
   38    39    42    43   1.00000 -1.0 2.0
   38    39    42    46  -0.54700  1.0 1.0
   38    39    42    46   1.23000 -1.0 2.0
   38    58    62    63   0.30150 -1.0 2.0
   38    58    62    64   0.30150 -1.0 2.0
   39    38    58    49   0.09850  1.0 1.0
   39    38    58    49   0.15250 -1.0 2.0
   39    38    58    49  -0.50650  1.0 3.0
   39    38    58    59   0.00000  1.0 1.0
   39    38    58    62  -0.51250  1.0 1.0
   39    38    58    62  -0.88800 -1.0 2.0
   39    38    58    62   0.08850  1.0 3.0
   39    40    44    45   1.50000 -1.0 2.0
   39    40    44    48  -1.18350  1.0 1.0
   39    40    44    48   1.45950 -1.0 2.0
   39    42    46    47   0.00000  1.0 1.0
   39    42   -46    49   0.25450  1.0 1.0
   39    42   -46    49  -0.61700 -1.0 2.0
   39    42   -46    49  -0.23550  1.0 3.0
   39    42    46    52  -0.12500  1.0 1.0
   39    42    46    52  -0.12500 -1.0 2.0
   39    42    46    52   0.25000  1.0 3.0
   40    39    42    43   1.00000 -1.0 2.0
   40    39    42    46   1.00000 -1.0 2.0
   40    44   -48    33   7.00000 -1.0 2.0
   40    44    48    55   7.00000 -1.0 2.0
   41    40    44    45  -0.11900  1.0 1.0
   41    40    44    45   0.76850 -1.0 2.0
   41    40    44    45   0.14100  1.0 3.0
   41    40    44    48   1.00000 -1.0 2.0
   44    48    55    56   0.00000  1.0 1.0
   44    48    55    57   0.00000  1.0 1.0
   44    48    55    60   0.09850  1.0 1.0
   44    48    55    60   0.15250 -1.0 2.0
   44    48    55    60  -0.50650  1.0 3.0
   45    44    48    33   7.00000 -1.0 2.0
   45    44    48    55   7.00000 -1.0 2.0
   48    33   -38    39  -0.28300  1.0 1.0
   48    33   -38    39   0.26700 -1.0 2.0
   48    33   -38    39  -0.63300  1.0 3.0
   48    33    38    58   0.09700  1.0 1.0
   48    33    38    58   0.15600 -1.0 2.0
   48    33    38    58  -0.50800  1.0 3.0
   48    55    60    61   0.15000  1.0 3.0
   48    55    60    65  -0.98800  1.0 1.0
   48    55    60    65   0.48800 -1.0 2.0
   48    55    60    65   0.76800  1.0 3.0
   48    55    60    68  -0.47300  1.0 1.0
   48    55    60    68   0.29700 -1.0 2.0
   48    55    60    68   0.83300  1.0 3.0
   55    60    65    66   0.41150 -1.0 2.0
   55    60    65    67   0.41150 -1.0 2.0
   55    60    68    69   0.17350  1.0 3.0
   55    60    68    70   0.17350  1.0 3.0
   55    60    68    71   0.17350  1.0 3.0
   56    55    60    61   0.15000  1.0 3.0
   56    55    60    65  -0.11250  1.0 3.0
   56    55    60    68   0.19200  1.0 3.0
   57    55    60    61   0.15000  1.0 3.0
   57    55    60    65  -0.11250  1.0 3.0
   57    55    60    68   0.19200  1.0 3.0
   61    60    65    66   0.00000  1.0 1.0
   61    60    65    67   0.00000  1.0 1.0
   61    60    68    69   0.13050  1.0 3.0
   61    60    68    70   0.13050  1.0 3.0
   61    60    68    71   0.13050  1.0 3.0
   65    60    68    69   0.17350  1.0 3.0
   65    60    68    70   0.17350  1.0 3.0
   65    60    68    71   0.17350  1.0 3.0
   68    60    65    66   0.30150 -1.0 2.0
   68    60    65    67   0.30150 -1.0 2.0
   42    39    40    41  -0.52200  1.0 1.0
   42    39    40    41   0.82950 -1.0 2.0
   42    39    40    44   1.50000 -1.0 2.0
   42    46    49    50   0.22950  1.0 3.0
   42    46    49    51   0.22950  1.0 3.0
   42    46    49    58   1.26750  1.0 1.0
   42    46    49    58  -0.00950 -1.0 2.0
   42    46    49    58   0.30600  1.0 3.0
   42    46    52    53   0.00000  1.0 1.0
   42    46    52    54   0.00000  1.0 1.0
   43    42    46    47   0.00000  1.0 1.0
   43    42    46    49   0.00000  1.0 1.0
   43    42    46    52   0.00000  1.0 1.0
   46    49   -58    38   0.34400  1.0 1.0
   46    49   -58    38   0.09450 -1.0 2.0
   46    49   -58    38   0.11100  1.0 3.0
   46    49    58    59   0.15000  1.0 3.0
   46    49    58    62  -0.84850  1.0 1.0
   46    49    58    62  -0.22800 -1.0 2.0
   46    49    58    62   0.29250  1.0 3.0
   47    46    49    50   0.15000  1.0 3.0
   47    46    49    51   0.15000  1.0 3.0
   47    46    49    58   0.15000  1.0 3.0
   47    46    52    53   0.00000  1.0 1.0
   47    46    52    54   0.00000  1.0 1.0
   49    46    52    53   0.00000  1.0 1.0
   49    46    52    54   0.00000  1.0 1.0
   49    58    62    63   0.41150 -1.0 2.0
   49    58    62    64   0.41150 -1.0 2.0
   50    49    58    38   0.15000  1.0 3.0
   50    49    58    59   0.15000  1.0 3.0
   50    49    58    62  -0.11250  1.0 3.0
   51    49    58    38   0.15000  1.0 3.0
   51    49    58    59   0.15000  1.0 3.0
   51    49    58    62  -0.11250  1.0 3.0
   58    38    39    40   7.00000 -1.0 2.0
   58    38   -39    42   7.00000 -1.0 2.0
   59    58    62    63   0.00000  1.0 1.0
   59    58    62    64   0.00000  1.0 1.0
   52    46    49    50  -0.03800  1.0 3.0
   52    46    49    51  -0.03800  1.0 3.0
   52    46    49    58  -0.84850  1.0 1.0
   52    46    49    58  -0.22800 -1.0 2.0
   52    46    49    58   0.29250  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    58    38    39   1.10000 -1.0 2.0
   40    42    39    38   1.10000 -1.0 2.0
   39    44    40    41  10.50000 -1.0 2.0
   40    45    44    48   1.10000 -1.0 2.0
   33    55    48    44   1.10000 -1.0 2.0
   66    60    65    67  10.50000 -1.0 2.0
   43    39    42    46   1.00000 -1.0 2.0
   63    58    62    64  10.50000 -1.0 2.0
   53    46    52    54  10.50000 -1.0 2.0
END
