* LIGAND DATABASE FILE (OPLS2005)
*
001      67    68    119    190     354
    1     0 S   NP   _N1_     1    28.71099    96.14908   -23.32802
    2     1 S   H    _HN1     2     1.02950    74.73648    11.23184
    3     1 S   H    _H1_     3     1.02829    36.33227   163.53546
    4     1 S   H    _H2_     4     1.02787   103.42875   -94.45353
    5     1 S   CT   _CA1     5     1.50105   139.23281   114.96213
    6     5 S   HC   _HA1     6     1.09573   105.20555    87.64059
    7     5 S   CO3  _C1_     7     1.53786   112.41095   -32.61135
    8     7 S   O2Z  _O11     8     1.26370   115.01518   -44.08045
    9     7 S   O2Z  _O12     9     1.26235   114.93954   135.03313
   10     5 S   CT   _CB1    10     1.53075   107.41647  -154.40179
   11    10 S   HC   HB11    11     1.09834   109.38067   -49.88309
   12    10 S   HC   HB12    12     1.09813   110.45547    66.72121
   13    10 S   CT   _CG1    13     1.52990   112.59496  -170.85660
   14    13 S   HC   HG11    14     1.09584   110.63048   -65.24380
   15    13 S   HC   HG12    15     1.09669   109.79770    53.98982
   16    13 S   C    _CD1    16     1.51798   112.19776   174.44423
   17    16 S   O    _OE1    17     1.22737   123.27719     6.57408
   18    16 S   N    _N2_    18     1.38631   111.68037  -173.50611
   19    18 S   H    _HN2    19     1.01596   119.01394     1.59250
   20    18 S   CT1  _CA2    20     1.46229   123.42555   177.83952
   21    20 S   HC   _HA2    21     1.09739   109.31655     3.72715
   22    20 S   C    _C2_    22     1.53603   108.96887  -111.77243
   23    22 S   O    _O2_    23     1.23073   122.21903  -150.72064
   24    20 S   CT   _CB2    32     1.53455   111.39501   125.66329
   25    24 S   HC   HB21    33     1.09424   109.36967    56.17721
   26    24 S   HC   HB22    34     1.09432   109.84619   175.02831
   27    22 S   N    _N3_    24     1.38316   113.82813    36.89366
   28    27 S   H    _HN3    25     1.01571   119.56576    -3.62547
   29    24 S   S    _SG2    35     1.83437   110.89310   -65.33261
   30    27 S   CT   _CA3    26     1.45278   123.23396   177.07149
   31    30 S   HC   HA31    27     1.09550   107.53174   -64.16998
   32    30 S   HC   HA32    28     1.09558   107.96655    52.27150
   33    29 S   CT   _C15    36     1.89360   102.15814   172.33814
   34    30 S   CO3  _C3_    29     1.52963   114.06747   174.25485
   35    34 S   O2Z  _O31    30     1.26378   116.06981    -0.45671
   36    34 S   O2Z  _O32    31     1.26427   114.41423   179.59895
   37    33 S   CM   _C11    37     1.51253   106.33597    56.60032
   38    37 S   HC   _H25    38     1.08705   118.67781    57.66392
   39    33 S   CT   _C18    47     1.61567   110.58119   177.34930
   40    37 S   CM   _C10    39     1.33530   123.73000  -123.05900
   41    40 S   HC   _H24    40     1.08397   121.19942  -178.56033
   42    39 S   CA   _C8_    48     1.55964   110.02621  -178.87482
   43    39 S   CT   _C16    60     1.56334   111.84652   -56.61918
   44    43 S   HC   _H27    61     1.09547   111.97795    67.46239
   45    43 S   HC   _H28    62     1.09758   110.81405  -173.72680
   46    43 S   HC   _H29    63     1.09331   113.34463   -53.27060
   47    39 S   CT   _C17    64     1.56238   112.19031    59.07258
   48    47 S   HC   _H30    65     1.09545   111.91156   -66.06222
   49    47 S   HC   _H31    66     1.09301   113.55370    54.77003
   50    47 S   HC   _H32    67     1.09760   110.70751   174.99739
   51    40 S   CO4  _C14    41     1.48070   121.48381     1.16600
   52    51 S   O    _O17    42     1.23102   118.12714  -174.09114
   53    42 S   CA   _C4_    49     1.40965   121.38686   -86.23587
   54    53 S   HA   _H20    50     1.08633   121.18595    -0.18557
   55    51 S   CMA  _C13    43     1.51685   119.01817     7.07063
   56    55 S   OM   _O16    44     1.26239   115.44259   172.85178
   57    53 S   CA   _C6_    51     1.39867   121.70711   178.71686
   58    57 S   HA   _H22    52     1.08608   119.33174  -179.73166
   59    33 S   CM   _C12    45     1.52081   105.92100   -61.74160
   60    59 S   HC   _H26    46     1.09110   115.60019   -56.83176
   61    57 S   CA   _C9_    53     1.38839   119.63608    -0.17017
   62    61 S   CA   _C7_    54     1.38748   120.36044    -0.20936
   63    62 S   HA   _H23    55     1.08632   120.48603  -179.47066
   64    61 S   OH   _O18    58     1.36534   121.23925  -179.89347
   65    64 S   HO   _H33    59     0.97242   108.47672     1.01182
   66    42 S   CA   _C5_    56     1.40942   121.66912    91.76029
   67    66 S   HA   _H21    57     1.08591   121.32701     0.37534
  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  11   5   4   3
  21   2   1   1  12   5  19   6   3  18  10   3   2   1   6   2
   1   1   5   3   8   4   3   2   7   3   1   1   6   5   3   2
   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    59    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    55    59    60    39    42    43    47  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    41    51    55    56    59    60    39    42    53    66    43    44    45    46    47    48    49    50  
   35    36  
   36  
    0  
   38    40    41    51    52    55    59    60    39    42    43    47  
   40    41    51    59    39  
   42    53    54    57    62    66    67    43    44    45    46    47    48    49    50    40    55    59    60  
   41    51    52    55    56    59  
   51    52    55  
   53    54    57    58    61    62    63    66    67    43    44    45    46    47    48    49    50    59  
   44    45    46    47    48    49    50    53    59    66  
   45    46    47  
   46    47  
   47  
   48    49    50    53    59    66  
   49    50  
   50  
    0  
   52    55    56    59    60  
   55    56    59  
   54    57    58    61    62    66    67    64  
   57    58    61    66  
   56    59    60  
   59    60  
   58    61    62    63    66    64    65  
   61    62    64  
   60  
    0  
   62    63    66    67    64    65  
   63    66    67    64    65  
   66    67    64  
   65    66  
    0  
   67  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660   0.115000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   43   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   56   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   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   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.510
   33    59   317.000  1.510
   33    39   268.000  1.529
   37    38   340.000  1.080
   37    40   549.000  1.340
   40    41   340.000  1.080
   40    51   320.000  1.462
   51    52   570.000  1.229
   51    55   270.000  1.476
   55    56   745.000  1.250
   55    59   465.000  1.376
   59    60   340.000  1.080
   39    42   317.000  1.510
   39    43   268.000  1.529
   39    47   268.000  1.529
   42    53   469.000  1.400
   42    66   469.000  1.400
   53    54   367.000  1.080
   53    57   469.000  1.400
   57    58   367.000  1.080
   57    61   469.000  1.400
   61    62   469.000  1.400
   61    64   450.000  1.364
   62    63   367.000  1.080
   62    66   469.000  1.400
   66    67   367.000  1.080
   64    65   553.000  0.945
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   340.000  1.090
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   340.000  1.090
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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  112.20000
   29    33    59    75.00000  112.20000
   29    33    39    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    40    70.00000  124.00000
   33    59    55    70.00000  124.00000
   33    59    60    35.00000  117.00000
   33    39    42    70.00000  112.17500
   33    39    43    58.35000  112.70000
   33    39    47    58.35000  112.70000
   37    40    41    35.00000  120.00000
   37    40    51    65.00000  118.96000
   40    37    38    35.00000  120.00000
   40    51    52    80.00000  123.72100
   40    51    55    65.00000  118.65900
   51    40    41    40.00000  117.72500
   51    55    56    85.00000  116.28000
   51    55    59    65.00000  114.61000
   55    51    52    80.00000  120.81000
   55    59    60    40.00000  120.50800
   59    33    37    70.00000  110.12100
   59    55    56    65.00000  137.10300
   39    33    37    70.00000  112.02700
   39    33    59    70.00000  112.02700
   39    42    53    70.00000  120.00000
   39    42    66    70.00000  120.00000
   39    43    44    37.50000  110.70000
   39    43    45    37.50000  110.70000
   39    43    46    37.50000  110.70000
   39    47    48    37.50000  110.70000
   39    47    49    37.50000  110.70000
   39    47    50    37.50000  110.70000
   42    53    54    35.00000  120.00000
   42    53    57    63.00000  120.00000
   42    66    62    63.00000  120.00000
   42    66    67    35.00000  120.00000
   53    57    58    35.00000  120.00000
   53    57    61    63.00000  120.00000
   57    53    54    35.00000  120.00000
   57    61    62    63.00000  120.00000
   57    61    64    70.00000  120.00000
   61    57    58    35.00000  120.00000
   61    62    63    35.00000  120.00000
   61    62    66    63.00000  120.00000
   61    64    65    35.00000  113.00000
   62    66    67    35.00000  120.00000
   66    42    53    63.00000  120.00000
   66    62    63    35.00000  120.00000
   64    61    62    70.00000  120.00000
   43    39    42    70.00000  112.17500
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
   47    39    42    70.00000  112.17500
   47    39    43    58.35000  112.70000
   49    47    48    33.00000  107.80000
   50    47    48    33.00000  107.80000
   50    47    49    33.00000  107.80000
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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    59  -0.62250  1.0 1.0
   24    29    33    59  -0.38450 -1.0 2.0
   24    29    33    59   0.81900  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.00000  1.0 1.0
   29    33    37    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    59    55   0.42700  1.0 1.0
   29    33    59    55  -0.70350 -1.0 2.0
   29    33    59    55  -0.43150  1.0 3.0
   29    33    59    60   0.00000  1.0 1.0
   29    33    39    42   0.56750  1.0 1.0
   29    33    39    42  -0.07550 -1.0 2.0
   29    33    39    42   0.20000  1.0 3.0
   29    33    39    43   0.44750  1.0 1.0
   29    33    39    43  -0.17800 -1.0 2.0
   29    33    39    43   0.20200  1.0 3.0
   29    33    39    47   0.44750  1.0 1.0
   29    33    39    47  -0.17800 -1.0 2.0
   29    33    39    47   0.20200  1.0 3.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37    40    51   7.00000 -1.0 2.0
   33    39    42    53   0.04150 -1.0 2.0
   33    39    42    66   0.04150 -1.0 2.0
   33    39    43    44   0.15000  1.0 3.0
   33    39    43    45   0.15000  1.0 3.0
   33    39    43    46   0.15000  1.0 3.0
   33    39    47    48   0.15000  1.0 3.0
   33    39    47    49   0.15000  1.0 3.0
   33    39    47    50   0.15000  1.0 3.0
   37    33    59    55  -0.28300  1.0 1.0
   37    33    59    55   0.26700 -1.0 2.0
   37    33    59    55  -0.63300  1.0 3.0
   37    33    59    60   0.00000  1.0 1.0
   37    33    39    42   0.21200  1.0 1.0
   37    33    39    42   0.16900 -1.0 2.0
   37    33    39    42  -1.15100  1.0 3.0
   37    33    39    43   0.34400  1.0 1.0
   37    33    39    43   0.09450 -1.0 2.0
   37    33    39    43   0.11100  1.0 3.0
   37    33    39    47   0.34400  1.0 1.0
   37    33    39    47   0.09450 -1.0 2.0
   37    33    39    47   0.11100  1.0 3.0
   37    40    51    52   1.00000 -1.0 2.0
   37    40   -51    55  -1.18350  1.0 1.0
   37    40   -51    55   1.45950 -1.0 2.0
   38    37    40    41   7.00000 -1.0 2.0
   38    37    40    51   7.00000 -1.0 2.0
   40    51    55    56   1.50000 -1.0 2.0
   40    51    55    59  -1.18350  1.0 1.0
   40    51    55    59   1.45950 -1.0 2.0
   41    40    51    52   0.00000  1.0 1.0
   41    40    51    55   0.93700 -1.0 2.0
   51    55   -59    33   7.00000 -1.0 2.0
   51    55    59    60   7.00000 -1.0 2.0
   52    51    55    56  -0.11900  1.0 1.0
   52    51    55    56   0.76850 -1.0 2.0
   52    51    55    56   0.14100  1.0 3.0
   52    51    55    59   1.00000 -1.0 2.0
   56    55    59    33   7.00000 -1.0 2.0
   56    55    59    60   7.00000 -1.0 2.0
   59    33    37    38   0.00000  1.0 1.0
   59    33   -37    40  -0.28300  1.0 1.0
   59    33   -37    40   0.26700 -1.0 2.0
   59    33   -37    40  -0.63300  1.0 3.0
   59    33    39    42   0.21200  1.0 1.0
   59    33    39    42   0.16900 -1.0 2.0
   59    33    39    42  -1.15100  1.0 3.0
   59    33    39    43   0.34400  1.0 1.0
   59    33    39    43   0.09450 -1.0 2.0
   59    33    39    43   0.11100  1.0 3.0
   59    33    39    47   0.34400  1.0 1.0
   59    33    39    47   0.09450 -1.0 2.0
   59    33    39    47   0.11100  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    40   0.09850  1.0 1.0
   39    33    37    40   0.15250 -1.0 2.0
   39    33    37    40  -0.50650  1.0 3.0
   39    33    59    55   0.09850  1.0 1.0
   39    33    59    55   0.15250 -1.0 2.0
   39    33    59    55  -0.50650  1.0 3.0
   39    33    59    60   0.00000  1.0 1.0
   39    42    53    54   3.62500 -1.0 2.0
   39    42    53    57   3.62500 -1.0 2.0
   39    42    66    62   3.62500 -1.0 2.0
   39    42    66    67   3.62500 -1.0 2.0
   42    39    43    44   0.43200  1.0 3.0
   42    39    43    45   0.43200  1.0 3.0
   42    39    43    46   0.43200  1.0 3.0
   42    39    47    48   0.43200  1.0 3.0
   42    39    47    49   0.43200  1.0 3.0
   42    39    47    50   0.43200  1.0 3.0
   42    53    57    58   3.62500 -1.0 2.0
   42    53    57    61   3.62500 -1.0 2.0
   53    42    66    62   3.62500 -1.0 2.0
   53    42    66    67   3.62500 -1.0 2.0
   53    57   -61    62   3.62500 -1.0 2.0
   53    57    61    64   3.62500 -1.0 2.0
   54    53    57    58   3.62500 -1.0 2.0
   54    53    57    61   3.62500 -1.0 2.0
   57    61    62    63   3.62500 -1.0 2.0
   57    61    62    66   3.62500 -1.0 2.0
   57    61    64    65   0.84100 -1.0 2.0
   58    57    61    62   3.62500 -1.0 2.0
   58    57    61    64   3.62500 -1.0 2.0
   61    62   -66    42   3.62500 -1.0 2.0
   61    62    66    67   3.62500 -1.0 2.0
   62    61    64    65   0.84100 -1.0 2.0
   63    62    66    42   3.62500 -1.0 2.0
   63    62    66    67   3.62500 -1.0 2.0
   66    42    53    54   3.62500 -1.0 2.0
   66    42   -53    57   3.62500 -1.0 2.0
   64    61    62    63   3.62500 -1.0 2.0
   64    61    62    66   3.62500 -1.0 2.0
   43    39    42    53   0.04150 -1.0 2.0
   43    39    42    66   0.04150 -1.0 2.0
   43    39    47    48   0.15000  1.0 3.0
   43    39    47    49   0.15000  1.0 3.0
   43    39    47    50   0.15000  1.0 3.0
   47    39    42    53   0.04150 -1.0 2.0
   47    39    42    66   0.04150 -1.0 2.0
   47    39    43    44   0.15000  1.0 3.0
   47    39    43    45   0.15000  1.0 3.0
   47    39    43    46   0.15000  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
   36    30    34    35  10.50000 -1.0 2.0
   33    38    37    40   1.10000 -1.0 2.0
   51    41    40    37   1.10000 -1.0 2.0
   40    55    51    52  10.50000 -1.0 2.0
   51    56    55    59   1.10000 -1.0 2.0
   33    60    59    55   1.10000 -1.0 2.0
   53    66    42    39   4.00000 -1.0 2.0
   57    54    53    42   1.10000 -1.0 2.0
   61    58    57    53   1.10000 -1.0 2.0
   62    64    61    57   4.00000 -1.0 2.0
   66    63    62    61   1.10000 -1.0 2.0
   62    67    66    42   1.10000 -1.0 2.0
END
