* LIGAND DATABASE FILE (OPLS2005)
*
001      57    57    101    157     301
    1     0 S   NP   _N1_     1    29.48308    95.04622   -18.64869
    2     1 S   H    _HN1     2     1.02836    44.36232   140.71335
    3     1 S   H    _H1_     3     1.02783    71.74231   -76.23810
    4     1 S   H    _H2_     4     1.02953    95.08962    31.41157
    5     1 S   CT   _CA1     5     1.50135   150.17902  -179.24671
    6     5 S   HC   _HA1     6     1.09567   105.23382    30.52638
    7     5 S   CO3  _C1_     7     1.53840   112.27190   -89.75678
    8     7 S   O2Z  _O11     8     1.26380   115.03519   -44.18943
    9     7 S   O2Z  _O12     9     1.26219   114.96928   134.90220
   10     5 S   CT   _CB1    10     1.53084   107.41397   148.53962
   11    10 S   HC   HB11    11     1.09818   109.50338   -48.48831
   12    10 S   HC   HB12    12     1.09829   110.38896    68.13905
   13    10 S   CT   _CG1    13     1.53000   112.61438  -169.53204
   14    13 S   HC   HG11    14     1.09482   110.42959   -59.22393
   15    13 S   HC   HG12    15     1.09635   110.12979    59.74577
   16    13 S   C    _CD1    16     1.51823   112.02883   179.65395
   17    16 S   O    _OE1    17     1.22764   123.06456   -15.15102
   18    16 S   N    _N2_    18     1.38544   111.83056   165.99529
   19    18 S   H    _HN2    19     1.01604   119.08931    -0.16902
   20    18 S   CT1  _CA2    20     1.46180   123.49103  -179.91607
   21    20 S   HC   _HA2    21     1.09744   109.18458   -13.37786
   22    20 S   C    _C2_    22     1.53447   108.56343  -128.70105
   23    22 S   O    _O2_    23     1.23030   122.43803  -151.00063
   24    20 S   CT   _CB2    32     1.53460   111.57603   108.70684
   25    24 S   HC   HB21    33     1.09390   110.07265    56.14906
   26    24 S   HC   HB22    34     1.09541   110.24741   173.75590
   27    22 S   N    _N3_    24     1.38402   113.52193    36.79435
   28    27 S   H    _HN3    25     1.01644   119.43784    -3.68870
   29    24 S   S    _SG2    35     1.83387   111.48868   -68.40222
   30    27 S   CT   _CA3    26     1.45266   123.07704   176.95278
   31    30 S   HC   HA31    27     1.09552   107.55792   -63.50793
   32    30 S   HC   HA32    28     1.09561   107.90885    52.88361
   33    29 S   CT   _C6_    36     1.87409   102.09176   125.73200
   34    30 S   CO3  _C3_    29     1.52907   114.17472   174.90930
   35    34 S   O2Z  _O31    30     1.26356   116.08177     1.23559
   36    34 S   O2Z  _O32    31     1.26433   114.39976  -178.74758
   37    33 S   CM   _C7_    37     1.51491   107.25333   -66.31648
   38    37 S   HC   _H8_    38     1.08739   118.25274    76.29523
   39    33 S   CM   _C10    51     1.52624   107.71104    59.73760
   40    39 S   HC   _H11    52     1.09333   113.06242    50.44674
   41    37 S   CM   _C8_    39     1.34188   124.34010  -104.29008
   42    41 S   HC   _H9_    40     1.08680   118.81024  -178.35741
   43    39 S   CMA  _C11    53     1.35070   130.01561  -131.02138
   44    43 S   OM   _O36    54     1.25997   135.69910    -0.13706
   45    41 S   CT   _C9_    41     1.49739   123.91848     2.59156
   46    45 S   HC   _H3_    42     1.09544   109.70835   132.96339
   47    43 S   CO3  _C12    55     1.55221   110.62164  -179.92087
   48    47 S   O2Z  _O35    56     1.26768   115.40726    89.48800
   49    47 S   O2Z  _O34    57     1.26785   115.30808   -88.97248
   50    45 S   CT   _C4_    43     1.52987   113.26732    11.37567
   51    50 S   HC   _H4_    44     1.09669   110.11180  -160.93345
   52    50 S   HC   _H5_    45     1.09634   109.57121    81.61025
   53    45 S   OH   _O33    49     1.42582   108.79853  -109.89886
   54    53 S   HO   _H10    50     0.97268   107.52092   -55.23963
   55    33 S   CT   _C5_    46     1.55509   107.66903   174.84379
   56    55 S   HC   _H6_    47     1.09865   111.11545   -48.68848
   57    55 S   HC   _H7_    48     1.10021   109.45913  -164.90186
  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  13   5  11   4   9   4   5   3   9   6   2   1
   1   7   5   4   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    55    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    50    55    56    57    39    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    45    50    51    52    55    56    57    39    40    43    44    47  
   35    36  
   36  
    0  
   38    41    42    45    46    50    55    56    57    53    39    40    43  
   41    42    45    55    39  
   40    43    44    47    48    49    41    50    55    56    57  
   43    44    47    55  
   42    45    46    50    51    52    55    53    54  
   45    46    50    53  
   44    47    48    49    55  
   47    48    49  
   46    50    51    52    55    56    57    53    54  
   50    51    52    55    53    54  
   48    49  
   49  
    0  
   51    52    55    56    57    53    54  
   52    55    56    57    53  
   55    56    57    53  
   54    55  
    0  
   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  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.7500   0.1050   0.600000   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   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    55   268.000  1.529
   33    39   317.000  1.510
   37    38   340.000  1.080
   37    41   549.000  1.340
   41    42   340.000  1.080
   41    45   317.000  1.510
   45    46   340.000  1.090
   45    50   268.000  1.529
   45    53   320.000  1.410
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    55   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   53    54   553.000  0.945
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    47   230.000  1.545
   47    48   656.000  1.250
   47    49   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    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    55    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    55    50    58.35000  112.70000
   33    55    56    37.50000  110.70000
   33    55    57    37.50000  110.70000
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   37    41    42    35.00000  120.00000
   37    41    45    70.00000  124.00000
   41    37    38    35.00000  120.00000
   41    45    46    35.00000  109.50000
   41    45    50    70.00000  112.02700
   41    45    53    90.00000  110.39200
   45    41    42    35.00000  117.00000
   45    50    51    37.50000  110.70000
   45    50    52    37.50000  110.70000
   45    50    55    58.35000  112.70000
   45    53    54    55.00000  108.50000
   50    45    46    37.50000  110.70000
   50    55    56    37.50000  110.70000
   50    55    57    37.50000  110.70000
   52    50    51    33.00000  107.80000
   55    33    37    70.00000  112.02700
   55    50    51    37.50000  110.70000
   55    50    52    37.50000  110.70000
   57    55    56    33.00000  107.80000
   53    45    46    35.00000  109.50000
   53    45    50    50.00000  109.50000
   39    33    37    70.00000  110.12100
   39    33    55    70.00000  112.02700
   39    43    44    65.00000  137.10300
   39    43    47    55.00000  124.75400
   43    39    40    40.00000  120.50800
   43    47    48    85.00000  113.83300
   43    47    49    85.00000  113.83300
   47    43    44    65.00000  121.00000
   49    47    48    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    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    55   0.01700  1.0 1.0
   24    29    33    55  -0.23550 -1.0 2.0
   24    29    33    55   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    55    50   0.44750  1.0 1.0
   29    33    55    50  -0.17800 -1.0 2.0
   29    33    55    50   0.20200  1.0 3.0
   29    33    55    56   0.15000  1.0 3.0
   29    33    55    57   0.15000  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    43   0.42700  1.0 1.0
   29    33    39    43  -0.70350 -1.0 2.0
   29    33    39    43  -0.43150  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    45   7.00000 -1.0 2.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    47   7.00000 -1.0 2.0
   37    33    55    50   0.34400  1.0 1.0
   37    33    55    50   0.09450 -1.0 2.0
   37    33    55    50   0.11100  1.0 3.0
   37    33    55    56   0.15000  1.0 3.0
   37    33    55    57   0.15000  1.0 3.0
   37    33    39    40   0.00000  1.0 1.0
   37    33    39    43  -0.28300  1.0 1.0
   37    33    39    43   0.26700 -1.0 2.0
   37    33    39    43  -0.63300  1.0 3.0
   37    41    45    46   0.00000  1.0 1.0
   37    41   -45    50   0.09850  1.0 1.0
   37    41   -45    50   0.15250 -1.0 2.0
   37    41   -45    50  -0.50650  1.0 3.0
   37    41    45    53   0.67800  1.0 1.0
   37    41    45    53   0.47050 -1.0 2.0
   37    41    45    53  -0.62500  1.0 3.0
   38    37    41    42   7.00000 -1.0 2.0
   38    37    41    45   7.00000 -1.0 2.0
   41    45    50    51   0.15000  1.0 3.0
   41    45    50    52   0.15000  1.0 3.0
   41    45    50    55   0.34400  1.0 1.0
   41    45    50    55   0.09450 -1.0 2.0
   41    45    50    55   0.11100  1.0 3.0
   41    45    53    54  -0.07800  1.0 1.0
   41    45    53    54  -0.21500 -1.0 2.0
   41    45    53    54  -0.03150  1.0 3.0
   42    41    45    46   0.33100  1.0 3.0
   42    41    45    50   0.00000  1.0 1.0
   42    41    45    53   0.00000  1.0 1.0
   45    50   -55    33   0.56750  1.0 1.0
   45    50   -55    33  -0.07550 -1.0 2.0
   45    50   -55    33   0.20000  1.0 3.0
   45    50    55    56   0.15000  1.0 3.0
   45    50    55    57   0.15000  1.0 3.0
   46    45    50    51   0.15000  1.0 3.0
   46    45    50    52   0.15000  1.0 3.0
   46    45    50    55   0.15000  1.0 3.0
   46    45    53    54   0.19450  1.0 3.0
   50    45    53    54  -0.11600  1.0 1.0
   50    45    53    54  -0.09450 -1.0 2.0
   50    45    53    54   0.21250  1.0 3.0
   51    50    55    33   0.15000  1.0 3.0
   51    50    55    56   0.15000  1.0 3.0
   51    50    55    57   0.15000  1.0 3.0
   52    50    55    33   0.15000  1.0 3.0
   52    50    55    56   0.15000  1.0 3.0
   52    50    55    57   0.15000  1.0 3.0
   55    33    37    38   0.00000  1.0 1.0
   55    33   -37    41   0.09850  1.0 1.0
   55    33   -37    41   0.15250 -1.0 2.0
   55    33   -37    41  -0.50650  1.0 3.0
   55    33    39    40   0.00000  1.0 1.0
   55    33    39    43   0.09850  1.0 1.0
   55    33    39    43   0.15250 -1.0 2.0
   55    33    39    43  -0.50650  1.0 3.0
   53    45    50    51   0.23400  1.0 3.0
   53    45    50    52   0.23400  1.0 3.0
   53    45    50    55   0.86500  1.0 1.0
   53    45    50    55  -0.17500 -1.0 2.0
   53    45    50    55   0.20800  1.0 3.0
   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    55    50   0.34400  1.0 1.0
   39    33    55    50   0.09450 -1.0 2.0
   39    33    55    50   0.11100  1.0 3.0
   39    33    55    56   0.15000  1.0 3.0
   39    33    55    57   0.15000  1.0 3.0
   39    43    47    48  -0.04000 -1.0 2.0
   39    43    47    48  -0.29050  1.0 3.0
   39    43    47    49  -0.04000 -1.0 2.0
   39    43    47    49  -0.29050  1.0 3.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    47   7.00000 -1.0 2.0
   44    43    47    48   1.68800 -1.0 2.0
   44    43    47    49   1.68800 -1.0 2.0
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
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    41   1.10000 -1.0 2.0
   45    42    41    37   1.10000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   47    44    43    39  15.00000 -1.0 2.0
   48    43    47    49  10.50000 -1.0 2.0
END
