* LIGAND DATABASE FILE (OPLS2005)
*
001      71    72    125    195     369
    1     0 S   NP   _N1_     1    29.07829    97.14192   -23.64144
    2     1 S   H    _HN1     2     1.02775   110.83948   -86.18875
    3     1 S   H    _H1_     3     1.02959    67.20268    15.67907
    4     1 S   H    _H2_     4     1.02830    41.16587  -179.92598
    5     1 S   CT   _CA1     5     1.50158   134.76017   112.20773
    6     5 S   HC   _HA1     6     1.09580   105.15779    99.78810
    7     5 S   CO3  _C1_     7     1.53749   112.45714   -20.23979
    8     7 S   O2Z  _O11     8     1.26357   114.97816   -41.05132
    9     7 S   O2Z  _O12     9     1.26241   114.91357   137.91608
   10     5 S   CT   _CB1    10     1.53081   107.38505  -142.39107
   11    10 S   HC   HB11    11     1.09828   109.12515   -50.94099
   12    10 S   HC   HB12    12     1.09814   110.47131    65.54398
   13    10 S   CT   _CG1    13     1.53032   112.79860  -172.07625
   14    13 S   HC   HG11    14     1.09591   110.48088   -67.59379
   15    13 S   HC   HG12    15     1.09668   109.90608    51.63895
   16    13 S   C    _CD1    16     1.51861   112.29965   171.83283
   17    16 S   O    _OE1    17     1.22728   123.23457     1.76103
   18    16 S   N    _N2_    18     1.38663   111.68764  -177.70936
   19    18 S   H    _HN2    19     1.01580   119.00994     0.51205
   20    18 S   CT1  _CA2    20     1.46201   123.38549   177.79220
   21    20 S   HC   _HA2    21     1.09747   109.26032     0.90784
   22    20 S   C    _C2_    22     1.53689   109.40251  -114.47332
   23    22 S   O    _O2_    23     1.23112   122.03854  -153.00813
   24    20 S   CT   _CB2    32     1.53406   111.35245   122.76962
   25    24 S   HC   HB21    33     1.09586   110.11546    53.26980
   26    24 S   HC   HB22    34     1.09430   109.91315   172.52073
   27    22 S   N    _N3_    24     1.38406   113.97058    34.58373
   28    27 S   H    _HN3    25     1.01467   118.98720    -0.50124
   29    24 S   S    _SG2    35     1.82882   111.41716   -67.98852
   30    27 S   CT   _CA3    26     1.45421   123.40825   175.28287
   31    30 S   HC   HA31    27     1.09499   109.19338    27.84185
   32    30 S   HC   HA32    28     1.09496   107.20033   144.78585
   33    29 S   CT   _C15    36     1.85490   100.24225   169.47649
   34    33 S   HC   _H6_    37     1.09687   106.09218   -58.00159
   35    30 S   CO3  _C3_    29     1.52868   112.92469   -95.53239
   36    35 S   O2Z  _O31    30     1.26404   115.25824   -50.54659
   37    35 S   O2Z  _O32    31     1.26337   115.05380   130.27524
   38    33 S   CM   _C11    38     1.52596   109.84342    61.92597
   39    38 S   CT   _C12    39     1.51615   113.83287    73.12286
   40    39 S   HC   _H11    40     1.09344   112.29862   170.59113
   41    39 S   HC   _H12    41     1.09742   108.67468   -72.59287
   42    38 S   CM   _C10    54     1.34596   119.45422  -108.77801
   43    42 S   HC   _H10    55     1.08477   118.78315    -0.52749
   44    39 S   CT1  _C13    42     1.53591   111.19409    49.64774
   45    44 S   HC   _H4_    43     1.09924   109.08620    68.06838
   46    42 S   CD   _C9_    56     1.48443   124.91602   176.08103
   47    46 S   HC   _H9_    57     1.09956   115.56001    -2.87780
   48    44 S   NT   _N6_    44     1.47580   111.55300   -52.89449
   49    48 S   H    _H13    45     1.02284   109.02756   178.64376
   50    44 S   CO3  _C17    51     1.54654   113.91268  -172.80001
   51    50 S   O2Z  _O40    52     1.26319   116.55904     7.80394
   52    50 S   O2Z  _O39    53     1.26717   114.58495  -170.76654
   53    46 S   NI   _N5_    58     1.28584   129.22185   179.17102
   54    33 S   CT1  _C14    46     1.54250   112.67559  -176.30965
   55    54 S   HC   _H5_    47     1.10102   108.10929   175.41533
   56    53 S   CT1  _C7_    59     1.46669   120.81223    -2.81299
   57    56 S   HC   _H3_    60     1.09778   110.31835   -47.00442
   58    54 S   CO3  _C16    48     1.54986   116.74980    59.19302
   59    58 S   O2Z  _O38    49     1.26478   115.55607    22.03749
   60    58 S   O2Z  _O37    50     1.26597   115.81639  -161.19265
   61    56 S   C5A  _C5_    61     1.48876   113.17842    76.81776
   62    56 S   CO3  _C8_    69     1.54365   106.51815  -164.20206
   63    62 S   O2Z  _O36    70     1.26492   116.38725   -59.46617
   64    62 S   O2Z  _O35    71     1.26623   114.54075   120.55898
   65    61 S   C5BD _C4_    62     1.37627   134.88495    12.97785
   66    65 S   HA   _H7_    63     1.07960   127.46006     0.93041
   67    65 S   C5BB _C6_    64     1.40027   103.34187  -178.14154
   68    67 S   N5A  _N4_    65     1.33109   113.55518    -0.61389
   69    67 S   OH   _O34    67     1.34104   128.64172   178.55734
   70    69 S   HO   _H8_    68     0.97428   109.72784    -5.43487
   71    61 S   OA   _O33    66     1.36743   115.87105  -165.45117
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  16   7   2   1   1  15  13   6   5   7   3   9   6   6   2   9
   4   3   1   1   8   4   3  10   6   2   1   1   9   4   1   1
   6   4   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    54    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    48    54    55    58    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44    48    49    54    55    58    59    60    42    43    46  
   38    39    48    54    55    58    42  
   36    37  
   37  
    0  
   39    40    41    44    45    48    54    55    58    50    42    43    46    47    53  
   40    41    44    45    48    49    54    50    51    52    42    43    46  
   41    44    45    48    50    42  
   44    45    48    50    42  
   43    46    47    53    56    44    54  
   46    47    53  
   45    48    49    54    55    58    50    51    52  
   48    49    54    50    51    52  
   47    53    56    57    61    62  
   53    56  
   49    54    55    58    59    60    50    51    52  
   54    55    58    50  
   51    52    54  
   52  
    0  
   56    57    61    65    71    62    63    64  
   55    58    59    60  
   58    59    60  
   57    61    65    66    67    68    71    62    63    64  
   61    65    71    62    63    64  
   59    60  
   60  
    0  
   65    66    67    68    71    69    62    63    64  
   63    64    65    71  
   64  
    0  
   66    67    68    71    69    70  
   67    68    71    69  
   68    71    69    70  
   71    69    70  
   70    71  
    0  
    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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760  -0.118300   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660  -0.037500   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   46   3.7500   0.1050   0.352800   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.040200   1.4250   1.2500   0.008598240   0.268726247
   48   3.3000   0.1700  -0.625000   1.8650   1.6500   0.051222218  -2.220205820
   49   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   53   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
   54   3.5000   0.0660  -0.037500   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   56   3.5000   0.0660   0.077500   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   58   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   61   3.5500   0.0700   0.233000   2.0020   1.7750   0.001000000  -0.843144165
   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   3.5500   0.0700  -0.455000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.184000   1.3810   1.2100   0.030040813   0.268726247
   67   3.5500   0.0700   0.608000   2.0020   1.7750   0.001000000  -0.843144165
   68   3.2500   0.1700  -0.413000   1.8650   1.6500   0.001000000  -0.511443539
   69   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   71   2.9000   0.1400  -0.122000   1.6450   1.4500   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    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    54   268.000  1.529
   38    39   317.000  1.510
   38    42   549.000  1.340
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    44   268.000  1.529
   44    45   340.000  1.090
   44    48   305.000  1.457
   44    50   317.000  1.522
   48    49   434.000  1.010
   48    54   305.000  1.457
   54    55   340.000  1.090
   54    58   317.000  1.522
   58    59   656.000  1.250
   58    60   656.000  1.250
   50    51   656.000  1.250
   50    52   656.000  1.250
   42    43   340.000  1.080
   42    46   320.000  1.464
   46    47   370.000  1.093
   46    53   500.000  1.261
   53    56   315.000  1.431
   56    57   340.000  1.090
   56    61   295.000  1.489
   56    62   317.000  1.522
   61    65   546.000  1.367
   61    71   340.000  1.360
   65    66   367.000  1.080
   65    67   469.000  1.421
   67    68   410.000  1.320
   67    69   450.000  1.364
   68    71   462.000  1.399
   69    70   553.000  0.945
   62    63   656.000  1.250
   62    64   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    54    75.00000  108.68000
   33    38    39    65.00000  117.92700
   33    38    42    70.00000  124.00000
   33    54    48    80.00000  111.22000
   33    54    55    37.50000  110.70000
   33    54    58    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    39    40    35.00000  109.50000
   38    39    41    35.00000  109.50000
   38    39    44    70.00000  112.02700
   38    42    43    35.00000  120.00000
   38    42    46    60.00000  120.31500
   39    44    45    37.50000  110.70000
   39    44    48    80.00000  111.22000
   39    44    50    63.00000  111.10000
   41    39    40    33.00000  107.80000
   44    39    40    37.50000  110.70000
   44    39    41    37.50000  110.70000
   44    48    49    50.00000  111.55300
   44    48    54    51.80000  107.20000
   44    50    51    70.00000  117.00000
   44    50    52    70.00000  117.00000
   48    44    45    50.00000  109.55000
   48    54    55    50.00000  109.55000
   48    54    58    75.00000  111.54000
   54    33    34    37.50000  110.70000
   54    33    38    70.00000  112.02700
   54    48    49    50.00000  111.55300
   54    58    59    70.00000  117.00000
   54    58    60    70.00000  117.00000
   58    54    55    35.00000  109.50000
   60    58    59    80.00000  126.00000
   50    44    45    35.00000  109.50000
   50    44    48    75.00000  111.54000
   52    50    51    80.00000  126.00000
   42    38    39    70.00000  124.00000
   42    46    47    40.00000  113.81000
   42    46    53    70.00000  121.86000
   46    42    43    40.00000  114.85300
   46    53    56    75.00000  114.96100
   53    46    47    45.00000  120.55300
   53    56    57    45.00000  110.38000
   53    56    61    80.00000  110.73400
   53    56    62    80.00000  108.92000
   56    61    65    50.00000  131.81400
   56    61    71    80.00000  116.10000
   56    62    63    70.00000  117.00000
   56    62    64    70.00000  117.00000
   61    56    57    45.00000  110.47400
   61    65    66    35.00000  126.90000
   61    65    67    70.00000  103.80000
   61    71    68    70.00000  108.90000
   65    67    68    70.00000  111.90000
   65    67    69    75.00000  125.92000
   67    65    66    35.00000  128.20000
   67    68    71    70.00000  105.30000
   67    69    70    35.00000  113.00000
   71    61    65    70.00000  110.60000
   69    67    68    90.00000  117.04000
   62    56    57    35.00000  109.50000
   62    56    61    70.00000  110.34000
   64    62    63    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    54   0.01700  1.0 1.0
   24    29    33    54  -0.23550 -1.0 2.0
   24    29    33    54   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.30250  1.0 1.0
   29    33    38    39  -0.14950 -1.0 2.0
   29    33    38    39   0.36900  1.0 3.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    54    48   0.56750  1.0 1.0
   29    33    54    48  -0.07550 -1.0 2.0
   29    33    54    48   0.20000  1.0 3.0
   29    33    54    55   0.15000  1.0 3.0
   29    33    54    58  -2.17200  1.0 1.0
   29    33    54    58  -0.85700 -1.0 2.0
   33    38    39    40   0.34800  1.0 3.0
   33    38    39    41   0.34800  1.0 3.0
   33    38    39    44   0.46850  1.0 1.0
   33    38    39    44   0.08550 -1.0 2.0
   33    38    39    44   0.09800  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    46   7.00000 -1.0 2.0
   33    54    58    59   0.00000  1.0 1.0
   33    54    58    60   0.00000  1.0 1.0
   34    33    38    39   0.34800  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    54    48   0.15000  1.0 3.0
   34    33    54    55   0.15000  1.0 3.0
   34    33    54    58  -0.03800  1.0 3.0
   38    33    54    48   0.59950  1.0 1.0
   38    33    54    48  -0.21400 -1.0 2.0
   38    33    54    48   0.56200  1.0 3.0
   38    33    54    55   0.15000  1.0 3.0
   38    33    54    58  -0.98800  1.0 1.0
   38    33    54    58   0.48800 -1.0 2.0
   38    33    54    58   0.76800  1.0 3.0
   38    39    44    45   0.15000  1.0 3.0
   38    39   -44    48   0.59950  1.0 1.0
   38    39   -44    48  -0.21400 -1.0 2.0
   38    39   -44    48   0.56200  1.0 3.0
   38    39    44    50  -0.98800  1.0 1.0
   38    39    44    50   0.48800 -1.0 2.0
   38    39    44    50   0.76800  1.0 3.0
   38    42    46    47   1.36050 -1.0 2.0
   38    42    46    53   1.09650  1.0 1.0
   38    42    46    53   0.48950 -1.0 2.0
   38    42    46    53   0.49400  1.0 3.0
   39    38    42    43   7.00000 -1.0 2.0
   39    38    42    46   7.00000 -1.0 2.0
   39    44    48    49  -0.15950  1.0 1.0
   39    44    48    49   0.34650 -1.0 2.0
   39    44    48    49   0.05750  1.0 3.0
   39    44    48    54   0.23450  1.0 1.0
   39    44    48    54   0.02050 -1.0 2.0
   39    44    48    54   0.25250  1.0 3.0
   39    44    50    51   0.00000  1.0 1.0
   39    44    50    52   0.00000  1.0 1.0
   40    39    44    45   0.15000  1.0 3.0
   40    39    44    48   0.15000  1.0 3.0
   40    39    44    50  -0.03800  1.0 3.0
   41    39    44    45   0.15000  1.0 3.0
   41    39    44    48   0.15000  1.0 3.0
   41    39    44    50  -0.03800  1.0 3.0
   44    48   -54    33   0.23450  1.0 1.0
   44    48   -54    33   0.02050 -1.0 2.0
   44    48   -54    33   0.25250  1.0 3.0
   44    48    54    55   0.28000  1.0 3.0
   44    48    54    58  -1.76800  1.0 1.0
   44    48    54    58   1.02600 -1.0 2.0
   44    48    54    58   0.19700  1.0 3.0
   45    44    48    49   0.20000  1.0 3.0
   45    44    48    54   0.28000  1.0 3.0
   45    44    50    51   0.00000  1.0 1.0
   45    44    50    52   0.00000  1.0 1.0
   48    44    50    51   0.30150 -1.0 2.0
   48    44    50    52   0.30150 -1.0 2.0
   48    54    58    59   0.30150 -1.0 2.0
   48    54    58    60   0.30150 -1.0 2.0
   49    48    54    33  -0.15950  1.0 1.0
   49    48    54    33   0.34650 -1.0 2.0
   49    48    54    33   0.05750  1.0 3.0
   49    48    54    55   0.20000  1.0 3.0
   49    48    54    58   0.21900  1.0 1.0
   49    48    54    58  -0.24900 -1.0 2.0
   49    48    54    58   0.15200  1.0 3.0
   54    33   -38    39   0.46850  1.0 1.0
   54    33   -38    39   0.08550 -1.0 2.0
   54    33   -38    39   0.09800  1.0 3.0
   54    33    38    42   0.09850  1.0 1.0
   54    33    38    42   0.15250 -1.0 2.0
   54    33    38    42  -0.50650  1.0 3.0
   55    54    58    59   0.00000  1.0 1.0
   55    54    58    60   0.00000  1.0 1.0
   50    44    48    49   0.21900  1.0 1.0
   50    44    48    49  -0.24900 -1.0 2.0
   50    44    48    49   0.15200  1.0 3.0
   50    44    48    54  -1.76800  1.0 1.0
   50    44    48    54   1.02600 -1.0 2.0
   50    44    48    54   0.19700  1.0 3.0
   42    38    39    40   0.00000  1.0 1.0
   42    38    39    41   0.00000  1.0 1.0
   42    38    39    44   0.09850  1.0 1.0
   42    38    39    44   0.15250 -1.0 2.0
   42    38    39    44  -0.50650  1.0 3.0
   42    46    53    56   6.00000 -1.0 2.0
   43    42    46    47   0.00000  1.0 1.0
   43    42    46    53   1.00600 -1.0 2.0
   46    53    56    57  -0.15000  1.0 3.0
   46    53    56    61  -0.12500  1.0 1.0
   46    53    56    61  -0.12500 -1.0 2.0
   46    53    56    61   0.25000  1.0 3.0
   46    53    56    62  -0.12500  1.0 1.0
   46    53    56    62  -0.12500 -1.0 2.0
   46    53    56    62   0.25000  1.0 3.0
   47    46    53    56  -0.02700  1.0 1.0
   47    46    53    56   5.27600 -1.0 2.0
   53    56    61    65   0.04300 -1.0 2.0
   53    56    61    71   0.04300 -1.0 2.0
   53    56    62    63   0.30150 -1.0 2.0
   53    56    62    64   0.30150 -1.0 2.0
   56    61    65    66   3.62500 -1.0 2.0
   56    61    65    67   3.62500 -1.0 2.0
   56    61    71    68   3.62500 -1.0 2.0
   57    56    61    65   0.00000  1.0 1.0
   57    56    61    71   0.00000  1.0 1.0
   57    56    62    63   0.00000  1.0 1.0
   57    56    62    64   0.00000  1.0 1.0
   61    56    62    63   0.30150 -1.0 2.0
   61    56    62    64   0.30150 -1.0 2.0
   61    65   -67    68   3.62500 -1.0 2.0
   61    65    67    69   3.62500 -1.0 2.0
   65    61   -71    68   3.62500 -1.0 2.0
   65    67   -68    71   3.62500 -1.0 2.0
   65    67    69    70   0.84100 -1.0 2.0
   66    65    67    68   3.62500 -1.0 2.0
   66    65    67    69   3.62500 -1.0 2.0
   67    68   -71    61   3.62500 -1.0 2.0
   68    67    69    70   0.49400 -1.0 2.0
   71    61    65    66   3.62500 -1.0 2.0
   71    61   -65    67   3.62500 -1.0 2.0
   69    67    68    71   3.62500 -1.0 2.0
   62    56    61    65   0.04300 -1.0 2.0
   62    56    61    71   0.04300 -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
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    42   1.10000 -1.0 2.0
   59    54    58    60  10.50000 -1.0 2.0
   51    44    50    52  10.50000 -1.0 2.0
   46    43    42    38   1.10000 -1.0 2.0
   42    47    46    53  10.50000 -1.0 2.0
   65    71    61    56   4.00000 -1.0 2.0
   67    66    65    61   1.10000 -1.0 2.0
   68    69    67    65   4.00000 -1.0 2.0
   63    56    62    64  10.50000 -1.0 2.0
END
