* LIGAND DATABASE FILE (OPLS2005)
*
001      57    57    100    157     298
    1     0 S   NP   _N1_     1    28.12099    97.02460   -22.69113
    2     1 S   H    _HN1     2     1.02947    77.82441   -31.04587
    3     1 S   H    _H1_     3     1.02830    31.75524   126.30886
    4     1 S   H    _H2_     4     1.02773   106.83486  -136.75566
    5     1 S   CT   _CA1     5     1.50191   134.22186    75.68500
    6     5 S   HC   _HA1     6     1.09575   105.17196    85.35385
    7     5 S   CO3  _C1_     7     1.53817   111.92000   -34.73530
    8     7 S   O2Z  _O11     8     1.26386   115.01248   -50.87498
    9     7 S   O2Z  _O12     9     1.26203   114.93199   127.55937
   10     5 S   CT   _CB1    10     1.53058   107.31836  -156.85273
   11    10 S   HC   HB11    11     1.09841   109.48142   -48.82636
   12    10 S   HC   HB12    12     1.09805   110.45833    67.74925
   13    10 S   CT   _CG1    13     1.53038   112.61801  -169.69015
   14    13 S   HC   HG11    14     1.09577   110.65068   -64.11791
   15    13 S   HC   HG12    15     1.09652   109.80667    55.12106
   16    13 S   C    _CD1    16     1.51861   111.87653   175.72529
   17    16 S   O    _OE1    17     1.22823   123.17001    10.82457
   18    16 S   N    _N2_    18     1.38439   112.08960  -169.62199
   19    18 S   H    _HN2    19     1.01850   119.34694    -1.02336
   20    18 S   CT1  _CA2    20     1.45867   122.69334  -179.14499
   21    20 S   HC   _HA2    21     1.09743   108.33380    35.81451
   22    20 S   C    _C2_    22     1.52991   107.60994   -81.63784
   23    22 S   O    _O2_    23     1.22973   123.18453   -28.04574
   24    20 S   CT   _CB2    32     1.53260   112.21945   158.72715
   25    24 S   HC   HB21    33     1.09427   109.43265    59.95897
   26    24 S   HC   HB22    34     1.09531   110.32003   177.97735
   27    22 S   N    _N3_    24     1.38549   112.50357   154.56457
   28    27 S   H    _HN3    25     1.01646   120.33974    -1.89114
   29    24 S   S    _SG2    35     1.82952   110.75087   -62.36822
   30    27 S   CT   _CA3    26     1.45333   122.41701   178.68121
   31    30 S   HC   HA31    27     1.09569   107.65229   -58.66681
   32    30 S   HC   HA32    28     1.09565   107.74722    57.63555
   33    29 S   CT   _C12    36     1.86280   101.54432   154.40827
   34    30 S   CO3  _C3_    29     1.52872   114.38924   179.44292
   35    34 S   O2Z  _O31    30     1.26328   116.10613    -2.83766
   36    34 S   O2Z  _O32    31     1.26447   114.39581   177.21505
   37    33 S   CM   _C6_    37     1.52668   106.62054    62.74613
   38    37 S   HC   _H4_    38     1.08747   117.27864   -78.97766
   39    33 S   CM   _C7_    53     1.52863   112.88160   -58.56101
   40    39 S   HC   _H5_    54     1.09218   114.08849   142.94098
   41    37 S   CM   _C4_    39     1.34596   122.43661   101.47805
   42    39 S   CMA  _C8_    55     1.35054   130.76327   -39.89529
   43    42 S   OM   _O3_    56     1.25829   134.33206     0.55813
   44    42 S   HC   _H6_    57     1.09298   110.78071  -178.82330
   45    41 S   NE   _N4_    40     1.38145   121.42831    -2.13258
   46    45 S   H    _H3_    41     1.01751   116.26497  -174.53539
   47    41 S   CO3  _C5_    50     1.55846   119.73011   178.90211
   48    47 S   O2Z  _O1_    51     1.26761   114.72470   170.63068
   49    47 S   O2Z  _O33    52     1.26480   116.59520    -9.68016
   50    45 S   CT1  _C11    42     1.45403   123.61954    -7.50804
   51    50 S   HC   _H9_    43     1.09687   108.92165   -85.57531
   52    33 S   CT   _C10    44     1.55843   108.83409  -178.43790
   53    52 S   HC   _H7_    45     1.10136   108.64947   166.36230
   54    52 S   HC   _H8_    46     1.09878   110.98824    50.91976
   55    50 S   CO3  _C9_    47     1.54043   107.39912   159.14906
   56    55 S   O2Z  _O4_    48     1.26724   114.78888    57.56378
   57    55 S   O2Z  _O5_    49     1.26326   116.53619  -123.63164
  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
  16   2   1   1  14   5   9   4   9   3   1   1  12   5   3   1
   1   7   6   5   2   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    52    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    50    52    53    54    39    40    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    45    50    51    52    53    54    55    47    39    40    42    43    44  
   35    36  
   36  
    0  
   38    41    45    46    50    52    53    54    47    48    49    39    40    42  
   41    45    52    47    39  
   40    42    43    44    41    50    52    53    54  
   42    43    44    52  
   45    46    50    51    52    55    47    48    49  
   43    44    52  
   44  
    0  
   46    50    51    52    53    54    55    56    57    47    48    49  
   50    51    52    55    47  
   48    49    50  
   49  
    0  
   51    52    53    54    55    56    57  
   52    53    54    55    56    57  
   53    54    55    56    57  
   54    55  
   55  
   56    57  
   57  
    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   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760  -0.292300   2.0020   1.7750   0.023028004  -0.852763146
   42   3.5500   0.0760   0.437200   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   44   2.5000   0.0500  -0.062100   1.4250   1.2500   0.008598240   0.268726247
   45   3.2500   0.1700  -0.494200   1.8650   1.6500   0.051222218  -2.220205820
   46   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   47   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   50   3.5000   0.0660  -0.037500   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
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    52   268.000  1.529
   33    39   317.000  1.510
   37    38   340.000  1.080
   37    41   549.000  1.340
   41    45   425.000  1.378
   41    47   230.000  1.545
   45    46   434.000  1.010
   45    50   382.000  1.448
   50    51   340.000  1.090
   50    52   268.000  1.529
   50    55   317.000  1.522
   52    53   340.000  1.090
   52    54   340.000  1.090
   55    56   656.000  1.250
   55    57   656.000  1.250
   47    48   656.000  1.250
   47    49   656.000  1.250
   39    40   340.000  1.080
   39    42   465.000  1.376
   42    43   745.000  1.250
   42    44   335.000  1.111
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    52    75.00000  111.63000
   29    33    39    75.00000  112.20000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    52    50    58.35000  112.70000
   33    52    53    37.50000  110.70000
   33    52    54    37.50000  110.70000
   33    39    40    35.00000  117.00000
   33    39    42    70.00000  124.00000
   37    41    45    70.00000  124.03900
   37    41    47    55.00000  124.75400
   41    37    38    35.00000  120.00000
   41    45    46    35.00000  114.50000
   41    45    50    50.00000  121.00000
   41    47    48    85.00000  113.83300
   41    47    49    85.00000  113.83300
   45    50    51    35.00000  109.50000
   45    50    52    80.00000  111.61500
   45    50    55    63.00000  110.10000
   50    45    46    35.00000  112.50000
   50    52    53    37.50000  110.70000
   50    52    54    37.50000  110.70000
   50    55    56    70.00000  117.00000
   50    55    57    70.00000  117.00000
   52    33    37    70.00000  112.02700
   52    50    51    37.50000  110.70000
   54    52    53    33.00000  107.80000
   55    50    51    35.00000  109.50000
   55    50    52    63.00000  111.10000
   57    55    56    80.00000  126.00000
   47    41    45    80.00000  114.48000
   49    47    48    80.00000  126.00000
   39    33    37    70.00000  110.12100
   39    33    52    70.00000  112.02700
   39    42    43    65.00000  137.10300
   39    42    44    45.00000  105.30000
   42    39    40    40.00000  120.50800
   44    42    43    50.00000  124.16400
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    52   0.01700  1.0 1.0
   24    29    33    52  -0.23550 -1.0 2.0
   24    29    33    52   0.21350  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   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    37    38   0.00000  1.0 1.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    52    50   0.44750  1.0 1.0
   29    33    52    50  -0.17800 -1.0 2.0
   29    33    52    50   0.20200  1.0 3.0
   29    33    52    53   0.15000  1.0 3.0
   29    33    52    54   0.15000  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    42   0.42700  1.0 1.0
   29    33    39    42  -0.70350 -1.0 2.0
   29    33    39    42  -0.43150  1.0 3.0
   33    37    41    45   7.00000 -1.0 2.0
   33    37    41    47   7.00000 -1.0 2.0
   33    39    42    43   7.00000 -1.0 2.0
   33    39    42    44   7.00000 -1.0 2.0
   37    33    52    50   0.34400  1.0 1.0
   37    33    52    50   0.09450 -1.0 2.0
   37    33    52    50   0.11100  1.0 3.0
   37    33    52    53   0.15000  1.0 3.0
   37    33    52    54   0.15000  1.0 3.0
   37    33    39    40   0.00000  1.0 1.0
   37    33    39    42  -0.28300  1.0 1.0
   37    33    39    42   0.26700 -1.0 2.0
   37    33    39    42  -0.63300  1.0 3.0
   37    41    45    46   1.00000 -1.0 2.0
   37    41   -45    50  -0.54700  1.0 1.0
   37    41   -45    50   1.23000 -1.0 2.0
   37    41    47    48  -0.04000 -1.0 2.0
   37    41    47    48  -0.29050  1.0 3.0
   37    41    47    49  -0.04000 -1.0 2.0
   37    41    47    49  -0.29050  1.0 3.0
   38    37    41    45   7.00000 -1.0 2.0
   38    37    41    47   7.00000 -1.0 2.0
   41    45    50    51   0.00000  1.0 1.0
   41    45    50    52   0.25450  1.0 1.0
   41    45    50    52  -0.61700 -1.0 2.0
   41    45    50    52  -0.23550  1.0 3.0
   41    45    50    55  -0.12500  1.0 1.0
   41    45    50    55  -0.12500 -1.0 2.0
   41    45    50    55   0.25000  1.0 3.0
   45    41    47    48   1.91650 -1.0 2.0
   45    41    47    49   1.91650 -1.0 2.0
   45    50   -52    33   1.26750  1.0 1.0
   45    50   -52    33  -0.00950 -1.0 2.0
   45    50   -52    33   0.30600  1.0 3.0
   45    50    52    53   0.22950  1.0 3.0
   45    50    52    54   0.22950  1.0 3.0
   45    50    55    56   0.00000  1.0 1.0
   45    50    55    57   0.00000  1.0 1.0
   46    45    50    51   0.00000  1.0 1.0
   46    45    50    52   0.00000  1.0 1.0
   46    45    50    55   0.00000  1.0 1.0
   51    50    52    33   0.15000  1.0 3.0
   51    50    52    53   0.15000  1.0 3.0
   51    50    52    54   0.15000  1.0 3.0
   51    50    55    56   0.00000  1.0 1.0
   51    50    55    57   0.00000  1.0 1.0
   52    33    37    38   0.00000  1.0 1.0
   52    33   -37    41   0.09850  1.0 1.0
   52    33   -37    41   0.15250 -1.0 2.0
   52    33   -37    41  -0.50650  1.0 3.0
   52    33    39    40   0.00000  1.0 1.0
   52    33    39    42   0.09850  1.0 1.0
   52    33    39    42   0.15250 -1.0 2.0
   52    33    39    42  -0.50650  1.0 3.0
   52    50    55    56   0.00000  1.0 1.0
   52    50    55    57   0.00000  1.0 1.0
   55    50    52    33  -0.84850  1.0 1.0
   55    50    52    33  -0.22800 -1.0 2.0
   55    50    52    33   0.29250  1.0 3.0
   55    50    52    53  -0.03800  1.0 3.0
   55    50    52    54  -0.03800  1.0 3.0
   47    41    45    46   1.82350 -1.0 2.0
   47    41    45    50   1.00000 -1.0 2.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    41  -0.28300  1.0 1.0
   39    33    37    41   0.26700 -1.0 2.0
   39    33    37    41  -0.63300  1.0 3.0
   39    33    52    50   0.34400  1.0 1.0
   39    33    52    50   0.09450 -1.0 2.0
   39    33    52    50   0.11100  1.0 3.0
   39    33    52    53   0.15000  1.0 3.0
   39    33    52    54   0.15000  1.0 3.0
   40    39    42    43   7.00000 -1.0 2.0
   40    39    42    44   7.00000 -1.0 2.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   33    38    37    41   1.10000 -1.0 2.0
   45    47    41    37   1.10000 -1.0 2.0
   50    41    45    46   1.00000 -1.0 2.0
   56    50    55    57  10.50000 -1.0 2.0
   48    41    47    49  10.50000 -1.0 2.0
   33    40    39    42  15.00000 -1.0 2.0
   43    44    42    39  15.00000 -1.0 2.0
END
