* LIGAND DATABASE FILE (OPLS2005)
*
001      66    66    114    172     334
    1     0 S   NP   _N1_     1    28.85392    93.73653   -20.98242
    2     1 S   H    _HN1     2     1.02862    96.60985     9.26194
    3     1 S   H    _H1_     3     1.02966    31.61645   121.75080
    4     1 S   H    _H2_     4     1.02796    83.69397   -98.39808
    5     1 S   CT   _CA1     5     1.50492   140.06207   144.42206
    6     5 S   HC   _HA1     6     1.09681   104.67755    50.93726
    7     5 S   CO3  _C1_     7     1.54433   110.86901   -65.08577
    8     7 S   O2Z  _O11     8     1.26140   116.78898  -117.88431
    9     7 S   O2Z  _O12     9     1.26523   113.80682    61.17882
   10     5 S   CT   _CB1    10     1.53065   107.06298   167.06738
   11    10 S   HC   HB11    11     1.09835   110.05298   -42.56545
   12    10 S   HC   HB12    12     1.09792   110.03907    74.02158
   13    10 S   CT   _CG1    13     1.53120   112.44495  -163.22785
   14    13 S   HC   HG11    14     1.09504   110.84672   -53.37153
   15    13 S   HC   HG12    15     1.09631   110.00583    65.63656
   16    13 S   C    _CD1    16     1.51764   111.87523  -174.22708
   17    16 S   O    _OE1    17     1.22753   123.10859   -10.51446
   18    16 S   N    _N2_    18     1.38600   111.86626   169.61501
   19    18 S   H    _HN2    19     1.01581   119.19756     2.59284
   20    18 S   CT1  _CA2    20     1.46285   123.14200  -175.70823
   21    20 S   HC   _HA2    21     1.09722   109.39020   -11.80590
   22    20 S   C    _C2_    22     1.53338   108.67177  -127.80921
   23    22 S   O    _O2_    23     1.23016   122.16409  -146.76597
   24    20 S   CT   _CB2    32     1.53491   111.13435   109.94873
   25    24 S   HC   HB21    33     1.09409   109.29577    59.63743
   26    24 S   HC   HB22    34     1.09516   110.67666   177.70723
   27    22 S   N    _N3_    24     1.38485   113.41108    40.61038
   28    27 S   H    _HN3    25     1.01526   118.91694    -0.50513
   29    24 S   S    _SG2    35     1.83033   111.50668   -62.75378
   30    27 S   CT   _CA3    26     1.45452   123.44994   175.17489
   31    30 S   HC   HA31    27     1.09522   109.25571    24.04141
   32    30 S   HC   HA32    28     1.09496   107.11645   141.04348
   33    29 S   CT   _C14    36     1.85165   100.33296   149.52160
   34    33 S   HC   _H3_    37     1.09749   105.66654    50.77559
   35    30 S   CO3  _C3_    29     1.52920   113.10129   -99.45248
   36    35 S   O2Z  _O31    30     1.26403   115.39617   -44.74482
   37    35 S   O2Z  _O32    31     1.26355   114.99274   136.19397
   38    33 S   CA   _C6_    38     1.52475   110.89175   -67.66049
   39    33 S   CT   _C15    53     1.55091   109.94008   167.87116
   40    39 S   HC   _H30    54     1.09809   109.22178    59.59401
   41    38 S   CA   _C4_    39     1.40552   119.15166   122.30122
   42    41 S   HA   _H21    40     1.08816   119.87796    -0.24147
   43    39 S   CO4  _C10    55     1.52892   111.96105   -59.88920
   44    43 S   O    _O15    56     1.23092   122.22324   -44.10854
   45    39 S   CO4  _C11    61     1.52818   110.73816   178.11135
   46    45 S   O    _O16    62     1.23099   121.99013    53.51924
   47    41 S   CA   _C7_    41     1.39795   119.74749   179.22570
   48    43 S   CT   _C12    57     1.50669   116.69542   138.43637
   49    48 S   HC   _H23    58     1.09244   109.64441    62.29897
   50    48 S   HC   _H24    59     1.09353   109.66721  -178.07797
   51    48 S   HC   _H25    60     1.09280   109.62778   -58.88062
   52    45 S   CT   _C13    63     1.50642   116.87140  -127.99326
   53    52 S   HC   _H26    64     1.09262   109.68567    59.84008
   54    52 S   HC   _H27    65     1.09351   109.65944   179.13815
   55    52 S   HC   _H28    66     1.09249   109.62000   -61.33486
   56    47 S   CA   _C9_    42     1.39094   121.53216     0.27124
   57    47 S   NO2  _N13    50     1.44594   118.10024  -179.86730
   58    57 S   ON   _O14    51     1.23821   116.95903   -56.26704
   59    57 S   ON   _O17    52     1.23785   117.37710   122.79706
   60    56 S   CA   _C8_    43     1.39198   118.73346    -0.36262
   61    56 S   OH   _O19    48     1.36554   121.07123   178.65856
   62    61 S   HO   _H32    49     0.97466   107.37089   179.64118
   63    38 S   CA   _C5_    44     1.40801   122.06399   -58.73434
   64    63 S   HA   _H22    45     1.08761   120.13404     0.58148
   65    60 S   OH   _O18    46     1.36744   118.22984   179.80617
   66    65 S   HO   _H31    47     0.97687   109.26166  -174.81681
  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  13  15   6  10   4   8   5   6   4   9   3
   2   1   1   3   2   1   1  10   4   1   1   6   3   1   3   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    63    39    40    43    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    47    60    63    64    39    40    43    44    48    45    46    52  
   38    41    63    39    40    43    45  
   36    37  
   37  
    0  
   41    42    47    56    60    63    64    65    57    39    40    43    45  
   40    43    44    48    49    50    51    45    46    52    53    54    55    41    63  
   43    44    48    45    46    52  
   42    47    56    60    63    64    61    57    58    59  
   47    56    63    57  
   44    48    49    50    51    45    46    52  
   48    49    50    51    45  
   46    52    53    54    55    48  
   52    53    54    55  
   56    60    63    65    61    62    57    58    59  
   49    50    51  
   50    51  
   51  
    0  
   53    54    55  
   54    55  
   55  
    0  
   60    63    64    65    66    61    62    57    58    59  
   58    59    60    61  
   59  
    0  
   63    64    65    66    61    62  
   62    63    65  
    0  
   64    65    66  
   65  
   66  
    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   0.222500   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   57   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   58   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   59   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   60   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   268.000  1.529
   38    41   469.000  1.400
   38    63   469.000  1.400
   41    42   367.000  1.080
   41    47   469.000  1.400
   47    56   469.000  1.400
   47    57   400.000  1.460
   56    60   469.000  1.400
   56    61   450.000  1.364
   60    63   469.000  1.400
   60    65   450.000  1.364
   63    64   367.000  1.080
   65    66   553.000  0.945
   61    62   553.000  0.945
   57    58   550.000  1.225
   57    59   550.000  1.225
   39    40   340.000  1.090
   39    43   317.000  1.522
   39    45   317.000  1.522
   43    44   570.000  1.229
   43    48   317.000  1.522
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   340.000  1.090
   45    46   570.000  1.229
   45    52   317.000  1.522
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   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    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    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    41    70.00000  120.00000
   33    38    63    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    43    63.00000  111.10000
   33    39    45    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    47    63.00000  120.00000
   38    63    60    63.00000  120.00000
   38    63    64    35.00000  120.00000
   41    47    56    63.00000  120.00000
   41    47    57    85.00000  120.00000
   47    41    42    35.00000  120.00000
   47    56    60    63.00000  120.00000
   47    56    61    70.00000  120.00000
   47    57    58    80.00000  117.50000
   47    57    59    80.00000  117.50000
   56    60    63    63.00000  120.00000
   56    60    65    70.00000  120.00000
   56    61    62    35.00000  113.00000
   60    63    64    35.00000  120.00000
   60    65    66    35.00000  113.00000
   63    38    41    63.00000  120.00000
   65    60    63    70.00000  120.00000
   61    56    60    70.00000  120.00000
   57    47    56    85.00000  120.00000
   59    57    58    80.00000  125.30000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    43    44    80.00000  120.40000
   39    43    48    70.00000  116.00000
   39    45    46    80.00000  120.40000
   39    45    52    70.00000  116.00000
   43    39    40    35.00000  109.50000
   43    48    49    35.00000  109.50000
   43    48    50    35.00000  109.50000
   43    48    51    35.00000  109.50000
   48    43    44    80.00000  120.40000
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    33.00000  107.80000
   45    39    40    35.00000  109.50000
   45    39    43    75.00000  107.99600
   45    52    53    35.00000  109.50000
   45    52    54    35.00000  109.50000
   45    52    55    35.00000  109.50000
   52    45    46    80.00000  120.40000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    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    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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  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    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    63  -0.16000  1.0 1.0
   29    33    38    63  -0.03200 -1.0 2.0
   29    33    38    63   0.04500  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   29    33    39    45   0.56750  1.0 1.0
   29    33    39    45  -0.07550 -1.0 2.0
   29    33    39    45   0.20000  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    47   3.62500 -1.0 2.0
   33    38    63    60   3.62500 -1.0 2.0
   33    38    63    64   3.62500 -1.0 2.0
   33    39    43    44   0.30150 -1.0 2.0
   33    39    43    48   0.60050  1.0 1.0
   33    39    43    48   0.05600 -1.0 2.0
   33    39    43    48   0.26150  1.0 3.0
   33    39    45    46   0.30150 -1.0 2.0
   33    39    45    52   0.60050  1.0 1.0
   33    39    45    52   0.05600 -1.0 2.0
   33    39    45    52   0.26150  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    63   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    43  -0.11250  1.0 3.0
   34    33    39    45  -0.11250  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    43   0.56750  1.0 1.0
   38    33    39    43  -0.07550 -1.0 2.0
   38    33    39    43   0.20000  1.0 3.0
   38    33    39    45   0.56750  1.0 1.0
   38    33    39    45  -0.07550 -1.0 2.0
   38    33    39    45   0.20000  1.0 3.0
   38    41    47    56   3.62500 -1.0 2.0
   38    41    47    57   3.62500 -1.0 2.0
   41    38    63    60   3.62500 -1.0 2.0
   41    38    63    64   3.62500 -1.0 2.0
   41    47   -56    60   3.62500 -1.0 2.0
   41    47    56    61   3.62500 -1.0 2.0
   41    47    57    58   0.69950 -1.0 2.0
   41    47    57    59   0.69950 -1.0 2.0
   42    41    47    56   3.62500 -1.0 2.0
   42    41    47    57   3.62500 -1.0 2.0
   47    56    60    63   3.62500 -1.0 2.0
   47    56    60    65   3.62500 -1.0 2.0
   47    56    61    62   0.84100 -1.0 2.0
   56    47    57    58   0.69950 -1.0 2.0
   56    47    57    59   0.69950 -1.0 2.0
   56    60   -63    38   3.62500 -1.0 2.0
   56    60    63    64   3.62500 -1.0 2.0
   56    60    65    66   0.84100 -1.0 2.0
   60    56    61    62   0.84100 -1.0 2.0
   63    38    41    42   3.62500 -1.0 2.0
   63    38   -41    47   3.62500 -1.0 2.0
   63    60    65    66   0.84100 -1.0 2.0
   65    60    63    38   3.62500 -1.0 2.0
   65    60    63    64   3.62500 -1.0 2.0
   61    56    60    63   3.62500 -1.0 2.0
   61    56    60    65   3.62500 -1.0 2.0
   57    47    56    60   3.62500 -1.0 2.0
   57    47    56    61   3.62500 -1.0 2.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33    38    63   0.04150 -1.0 2.0
   39    43    48    49   0.00000  1.0 1.0
   39    43    48    50   0.00000  1.0 1.0
   39    43    48    51   0.00000  1.0 1.0
   39    45    52    53   0.00000  1.0 1.0
   39    45    52    54   0.00000  1.0 1.0
   39    45    52    55   0.00000  1.0 1.0
   40    39    43    44   0.00000  1.0 1.0
   40    39    43    48   0.00000  1.0 1.0
   40    39    45    46   0.00000  1.0 1.0
   40    39    45    52   0.00000  1.0 1.0
   43    39    45    46   0.30150 -1.0 2.0
   43    39    45    52   0.65300  1.0 1.0
   43    39    45    52  -0.03850 -1.0 2.0
   43    39    45    52   0.33900  1.0 3.0
   44    43    48    49   0.00000  1.0 1.0
   44    43    48    50   0.00000  1.0 1.0
   44    43    48    51   0.00000  1.0 1.0
   45    39    43    44   0.30150 -1.0 2.0
   45    39    43    48   0.65300  1.0 1.0
   45    39    43    48  -0.03850 -1.0 2.0
   45    39    43    48   0.33900  1.0 3.0
   46    45    52    53   0.00000  1.0 1.0
   46    45    52    54   0.00000  1.0 1.0
   46    45    52    55   0.00000  1.0 1.0
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
   37    30    35    36  10.50000 -1.0 2.0
   41    63    38    33   4.00000 -1.0 2.0
   47    42    41    38   1.10000 -1.0 2.0
   56    57    47    41   4.00000 -1.0 2.0
   60    61    56    47   4.00000 -1.0 2.0
   63    65    60    56   4.00000 -1.0 2.0
   60    64    63    38   1.10000 -1.0 2.0
   59    47    57    58  10.50000 -1.0 2.0
   39    48    43    44  10.50000 -1.0 2.0
   39    52    45    46  10.50000 -1.0 2.0
END
