* LIGAND DATABASE FILE (OPLS2005)
*
001      74    75    133    216     405
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02031   104.20519     6.76445
    3     1 S   H    _H1_     3     1.02125    43.95281   109.08563
    4     1 S   H    _H2_     4     1.02161    69.09397   -98.13154
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08491   110.62044    58.72541
   26    24 S   HC   HB22    34     1.08519   110.01707   179.21765
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C17    36     1.87330    96.36536   161.86617
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CM   _C10    37     1.51571   104.98917   -60.03605
   38    37 S   HC   _H14    38     1.08837   116.74622    86.94652
   39    33 S   CT   _C16    53     1.54934   107.94038    61.69636
   40    39 S   HC   _H16    54     1.10194   109.98059   -49.45840
   41    37 S   CM   _C11    39     1.34383   124.61843   -92.39009
   42    39 S   C    _C14    55     1.50649   113.08129  -165.46447
   43    42 S   O    _O7_    56     1.22231   125.05481   -30.59985
   44    41 S   CO4  _C12    40     1.48947   119.32466     1.86708
   45    44 S   O    _O5_    41     1.22187   123.59082   173.97091
   46    42 S   OH   _O8_    57     1.35586   110.71516   149.58400
   47    46 S   HO   _H17    58     0.98042   111.96358   179.81443
   48    41 S   CT   _C6_    63     1.49529   123.35280   179.69739
   49    48 S   HC   _H6_    64     1.09632   108.72998  -150.03090
   50    48 S   HC   _H7_    65     1.09615   107.61129   -34.58097
   51    44 S   CO4  _C13    42     1.50781   118.19658    -5.73101
   52    51 S   O    _O6_    43     1.22146   118.39193   161.79355
   53    48 S   CT1  _C4_    66     1.53298   112.24511    86.82145
   54    53 S   HC   _H5_    67     1.09733   109.44914   -59.98406
   55    33 S   CT1  _C15    44     1.54286   110.94770  -179.01543
   56    55 S   HC   _H15    45     1.09879   110.62659   179.52194
   57    53 S   NT   _N4_    68     1.46137   110.27584   179.36665
   58    57 S   H    _H3_    69     0.99602   118.01625  -156.15119
   59    57 S   H    _H4_    70     0.99655   117.96504    37.13556
   60    53 S   C    _C5_    71     1.51947   112.86009    60.64514
   61    60 S   O    _O1_    72     1.22422   125.22411    88.74385
   62    55 S   NT   _N5_    46     1.46513   113.16019   -59.04205
   63    62 S   H    _H9_    47     1.01936   108.79857    61.52627
   64    60 S   OH   _O33    73     1.36012   112.09578   -91.54310
   65    64 S   HO   _H8_    74     0.98075   114.82356  -179.79826
   66    62 S   CT1  _C7_    48     1.46607   112.20252   -58.69432
   67    66 S   HC   _H10    49     1.10606   107.66876   167.97566
   68    66 S   CT   _C9_    50     1.53609   115.48001    47.73738
   69    68 S   HC   _H11    51     1.09797   109.95176  -164.65682
   70    68 S   HC   _H12    52     1.09736   107.85430    80.73436
   71    66 S   C    _C8_    59     1.49904   108.94058   -79.30123
   72    71 S   O    _O3_    60     1.22229   125.03788     5.18194
   73    71 S   OH   _O4_    61     1.35550   110.69801  -174.69999
   74    73 S   HO   _H13    62     0.98020   111.89134   179.88465
  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  12   5   4   3
  20   2   1   1  16   5  16   8  12   8   3  10   4   2   1  11
   5   4   6   3   8   6   7   3   5   2   1   3   2   9   4   1
   1   8   6   5   2   1   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    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    51    55    56    62    68    39    40    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    44    51    52    55    56    62    63    66    68    69    70    39    40    42    43    46    48  
   35    36  
   36  
    0  
   38    41    44    45    51    55    56    62    68    39    40    42    48    49    50    53  
   41    44    55    39    48  
   40    42    43    46    47    71    41    51    55    56    62    66    67    68    69    70  
   42    43    46    55    66    68    69    70  
   44    45    51    52    55    48    49    50    53    54    57    60  
   43    46    47    55    66    68    69    70  
   46    47    68  
   45    51    52    55    56    62    48    49    50    53  
   51    52    55    48  
   47    68  
    0  
   49    50    53    54    57    58    59    60    61    64    51  
   50    53    54    57    60  
   53    54    57    60  
   52    55    56    62    63    66  
   55    56    62  
   54    57    58    59    60    61    64    65  
   57    58    59    60    61    64  
   56    62    63    66    67    68    71  
   62    63    66  
   58    59    60    61    64  
   59    60  
   60  
   61    64    65  
   64    65  
   63    66    67    68    69    70    71    72    73  
   66    67    68    71  
   65  
    0  
   67    68    69    70    71    72    73    74  
   68    69    70    71    72    73  
   69    70    71    72    73  
   70    71  
   71  
   72    73    74  
   73    74  
   74  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   42   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   44   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.5000   0.0660   0.163900   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   57   3.3000   0.1700  -0.943900   1.8650   1.6500   0.051222218  -2.220205820
   58   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   59   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   60   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   62   3.3000   0.1700  -0.625000   1.8650   1.6500   0.051222218  -2.220205820
   63   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   64   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   72   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   73   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   74   0.5000   0.0300   0.450000   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    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   268.000  1.529
   37    38   340.000  1.080
   37    41   549.000  1.340
   41    44   320.000  1.462
   41    48   317.000  1.510
   44    45   570.000  1.229
   44    51   250.000  1.523
   51    52   570.000  1.229
   51    55   255.000  1.522
   55    56   340.000  1.090
   55    62   305.000  1.457
   62    63   434.000  1.010
   62    66   305.000  1.457
   66    67   340.000  1.090
   66    68   268.000  1.529
   66    71   317.000  1.522
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    39   268.000  1.529
   39    40   340.000  1.090
   39    42   317.000  1.522
   42    43   570.000  1.229
   42    46   450.000  1.364
   46    47   553.000  0.945
   71    72   570.000  1.229
   71    73   450.000  1.364
   73    74   553.000  0.945
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    53   268.000  1.529
   53    54   340.000  1.090
   53    57   305.000  1.457
   53    60   317.000  1.522
   57    58   434.000  1.010
   57    59   434.000  1.010
   60    61   570.000  1.229
   60    64   450.000  1.364
   64    65   553.000  0.945
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  108.68000
   29    33    39    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    55    51    70.00000  110.61500
   33    55    56    37.50000  110.70000
   33    55    62    80.00000  111.22000
   33    39    68    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    42    63.00000  111.10000
   37    41    44    65.00000  118.96000
   37    41    48    70.00000  124.00000
   41    37    38    35.00000  120.00000
   41    44    45    80.00000  123.72100
   41    44    51    65.00000  116.00000
   41    48    49    35.00000  109.50000
   41    48    50    35.00000  109.50000
   41    48    53    70.00000  112.02700
   44    51    52    80.00000  119.30300
   44    51    55    65.00000  115.45000
   51    44    45    80.00000  119.30300
   51    55    56    45.00000  110.09800
   51    55    62    75.00000  112.91400
   55    33    37    70.00000  112.02700
   55    51    52    75.00000  123.42600
   55    62    63    50.00000  111.55300
   55    62    66    51.80000  107.20000
   62    55    56    50.00000  109.55000
   62    66    67    50.00000  109.55000
   62    66    68    80.00000  111.22000
   62    66    71    75.00000  111.54000
   66    62    63    50.00000  111.55300
   66    68    69    37.50000  110.70000
   66    68    70    37.50000  110.70000
   66    68    39    58.35000  112.70000
   66    71    72    80.00000  120.40000
   66    71    73    80.00000  116.87500
   68    66    67    37.50000  110.70000
   68    39    40    37.50000  110.70000
   68    39    42    63.00000  111.10000
   70    68    69    33.00000  107.80000
   39    33    37    70.00000  112.02700
   39    33    55    58.35000  112.70000
   39    68    69    37.50000  110.70000
   39    68    70    37.50000  110.70000
   39    42    43    80.00000  120.40000
   39    42    46    70.00000  108.00000
   42    39    40    35.00000  109.50000
   42    46    47    35.00000  113.00000
   46    42    43   100.00000  123.32000
   71    66    67    35.00000  109.50000
   71    66    68    63.00000  111.10000
   71    73    74    35.00000  113.00000
   73    71    72   100.00000  123.32000
   48    41    44    65.00000  116.34900
   48    53    54    37.50000  110.70000
   48    53    57    80.00000  111.22000
   48    53    60    63.00000  111.10000
   50    48    49    33.00000  107.80000
   53    48    49    37.50000  110.70000
   53    48    50    37.50000  110.70000
   53    57    58    50.00000  111.55300
   53    57    59    50.00000  111.55300
   53    60    61    80.00000  120.40000
   53    60    64    80.00000  116.87500
   57    53    54    50.00000  109.55000
   59    57    58    43.60000  106.40000
   60    53    54    35.00000  109.50000
   60    53    57    75.00000  111.54000
   60    64    65    35.00000  113.00000
   64    60    61   100.00000  123.32000
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   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.00000  1.0 1.0
   29    33    37    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    51  -2.17200  1.0 1.0
   29    33    55    51  -0.85700 -1.0 2.0
   29    33    55    56   0.15000  1.0 3.0
   29    33    55    62   0.56750  1.0 1.0
   29    33    55    62  -0.07550 -1.0 2.0
   29    33    55    62   0.20000  1.0 3.0
   29    33    39    68   0.44750  1.0 1.0
   29    33    39    68  -0.17800 -1.0 2.0
   29    33    39    68   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    42   0.56750  1.0 1.0
   29    33    39    42  -0.07550 -1.0 2.0
   29    33    39    42   0.20000  1.0 3.0
   33    37    41    44   7.00000 -1.0 2.0
   33    37    41    48   7.00000 -1.0 2.0
   33    55    62    63  -0.15950  1.0 1.0
   33    55    62    63   0.34650 -1.0 2.0
   33    55    62    63   0.05750  1.0 3.0
   33    55    62    66   0.23450  1.0 1.0
   33    55    62    66   0.02050 -1.0 2.0
   33    55    62    66   0.25250  1.0 3.0
   33    39    42    43   0.30150 -1.0 2.0
   33    39    42    46   0.50000  1.0 1.0
   33    39    42    46   0.27300 -1.0 2.0
   33    39    42    46   0.22500  1.0 3.0
   37    33    55    51  -0.98800  1.0 1.0
   37    33    55    51   0.48800 -1.0 2.0
   37    33    55    51   0.76800  1.0 3.0
   37    33    55    56   0.15000  1.0 3.0
   37    33    55    62   0.59950  1.0 1.0
   37    33    55    62  -0.21400 -1.0 2.0
   37    33    55    62   0.56200  1.0 3.0
   37    33    39    68   0.34400  1.0 1.0
   37    33    39    68   0.09450 -1.0 2.0
   37    33    39    68   0.11100  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    42  -0.98800  1.0 1.0
   37    33    39    42   0.48800 -1.0 2.0
   37    33    39    42   0.76800  1.0 3.0
   37    41    44    45   1.00000 -1.0 2.0
   37    41   -44    51   0.50400  1.0 1.0
   37    41   -44    51   1.60000 -1.0 2.0
   37    41   -44    51  -0.01800  1.0 3.0
   37    41    48    49   0.00000  1.0 1.0
   37    41    48    50   0.00000  1.0 1.0
   37    41    48    53   0.09850  1.0 1.0
   37    41    48    53   0.15250 -1.0 2.0
   37    41    48    53  -0.50650  1.0 3.0
   38    37    41    44   7.00000 -1.0 2.0
   38    37    41    48   7.00000 -1.0 2.0
   41    44    51    52   0.03000  1.0 1.0
   41    44    51    52   0.58800 -1.0 2.0
   41    44    51    52   0.15550  1.0 3.0
   41    44    51    55   0.43900  1.0 1.0
   41    44    51    55  -0.18150 -1.0 2.0
   41    44    51    55  -0.03650  1.0 3.0
   41    48    53    54   0.15000  1.0 3.0
   41    48    53    57   0.59950  1.0 1.0
   41    48    53    57  -0.21400 -1.0 2.0
   41    48    53    57   0.56200  1.0 3.0
   41    48    53    60  -0.98800  1.0 1.0
   41    48    53    60   0.48800 -1.0 2.0
   41    48    53    60   0.76800  1.0 3.0
   44    41    48    49   0.15000  1.0 3.0
   44    41    48    50   0.15000  1.0 3.0
   44    41    48    53   0.09700  1.0 1.0
   44    41    48    53   0.15600 -1.0 2.0
   44    41    48    53  -0.50800  1.0 3.0
   44    51   -55    33   0.65300  1.0 1.0
   44    51   -55    33  -0.03850 -1.0 2.0
   44    51   -55    33   0.33900  1.0 3.0
   44    51    55    56   0.00000  1.0 1.0
   44    51    55    62   0.65300  1.0 1.0
   44    51    55    62  -0.03850 -1.0 2.0
   44    51    55    62   0.33900  1.0 3.0
   45    44    51    52   0.06100 -1.0 2.0
   45    44    51    55   0.49600 -1.0 2.0
   51    55    62    63   0.21900  1.0 1.0
   51    55    62    63  -0.24900 -1.0 2.0
   51    55    62    63   0.15200  1.0 3.0
   51    55    62    66  -1.76800  1.0 1.0
   51    55    62    66   1.02600 -1.0 2.0
   51    55    62    66   0.19700  1.0 3.0
   52    51    55    33   0.00000  1.0 1.0
   52    51    55    56   0.00000  1.0 1.0
   52    51    55    62   0.30150 -1.0 2.0
   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    68   0.56750  1.0 1.0
   55    33    39    68  -0.07550 -1.0 2.0
   55    33    39    68   0.20000  1.0 3.0
   55    33    39    40   0.15000  1.0 3.0
   55    33    39    42  -0.84850  1.0 1.0
   55    33    39    42  -0.22800 -1.0 2.0
   55    33    39    42   0.29250  1.0 3.0
   55    62    66    67   0.28000  1.0 3.0
   55    62   -66    68   0.23450  1.0 1.0
   55    62   -66    68   0.02050 -1.0 2.0
   55    62   -66    68   0.25250  1.0 3.0
   55    62    66    71  -1.76800  1.0 1.0
   55    62    66    71   1.02600 -1.0 2.0
   55    62    66    71   0.19700  1.0 3.0
   56    55    62    63   0.20000  1.0 3.0
   56    55    62    66   0.28000  1.0 3.0
   62    66    68    69   0.15000  1.0 3.0
   62    66    68    70   0.15000  1.0 3.0
   62    66    68    39   1.53400  1.0 1.0
   62    66    68    39  -0.09950 -1.0 2.0
   62    66    68    39   0.05700  1.0 3.0
   62    66    71    72   0.30150 -1.0 2.0
   62    66    71    73   0.40000  1.0 3.0
   63    62    66    67   0.20000  1.0 3.0
   63    62    66    68  -0.15950  1.0 1.0
   63    62    66    68   0.34650 -1.0 2.0
   63    62    66    68   0.05750  1.0 3.0
   63    62    66    71   0.21900  1.0 1.0
   63    62    66    71  -0.24900 -1.0 2.0
   63    62    66    71   0.15200  1.0 3.0
   66    68   -39    33   0.56750  1.0 1.0
   66    68   -39    33  -0.07550 -1.0 2.0
   66    68   -39    33   0.20000  1.0 3.0
   66    68    39    40   0.15000  1.0 3.0
   66    68    39    42  -0.84850  1.0 1.0
   66    68    39    42  -0.22800 -1.0 2.0
   66    68    39    42   0.29250  1.0 3.0
   66    71    73    74   1.50000  1.0 1.0
   66    71    73    74   2.45000 -1.0 2.0
   67    66    68    69   0.15000  1.0 3.0
   67    66    68    70   0.15000  1.0 3.0
   67    66    68    39   0.15000  1.0 3.0
   67    66    71    72   0.00000  1.0 1.0
   67    66    71    73   0.00000  1.0 1.0
   68    66    71    72   0.00000  1.0 1.0
   68    66    71    73   0.50000  1.0 1.0
   68    66    71    73   0.27300 -1.0 2.0
   68    66    71    73   0.22500  1.0 3.0
   68    39    42    43   0.30150 -1.0 2.0
   68    39    42    46   0.50000  1.0 1.0
   68    39    42    46   0.27300 -1.0 2.0
   68    39    42    46   0.22500  1.0 3.0
   69    68    39    33   0.15000  1.0 3.0
   69    68    39    40   0.15000  1.0 3.0
   69    68    39    42  -0.11250  1.0 3.0
   70    68    39    33   0.15000  1.0 3.0
   70    68    39    40   0.15000  1.0 3.0
   70    68    39    42  -0.11250  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    41   0.09850  1.0 1.0
   39    33    37    41   0.15250 -1.0 2.0
   39    33    37    41  -0.50650  1.0 3.0
   39    33    55    51  -0.84850  1.0 1.0
   39    33    55    51  -0.22800 -1.0 2.0
   39    33    55    51   0.29250  1.0 3.0
   39    33    55    56   0.15000  1.0 3.0
   39    33   -55    62   1.53400  1.0 1.0
   39    33   -55    62  -0.09950 -1.0 2.0
   39    33   -55    62   0.05700  1.0 3.0
   39    42    46    47   1.50000  1.0 1.0
   39    42    46    47   2.45000 -1.0 2.0
   40    39    42    43   0.00000  1.0 1.0
   40    39    42    46   0.00000  1.0 1.0
   43    42    46    47   0.92200  1.0 1.0
   43    42    46    47   3.74100 -1.0 2.0
   71    66    68    69  -0.03800  1.0 3.0
   71    66    68    70  -0.03800  1.0 3.0
   71    66    68    39  -0.84850  1.0 1.0
   71    66    68    39  -0.22800 -1.0 2.0
   71    66    68    39   0.29250  1.0 3.0
   72    71    73    74   0.92200  1.0 1.0
   72    71    73    74   3.74100 -1.0 2.0
   48    41    44    45  -0.64400  1.0 1.0
   48    41    44    45   0.26850 -1.0 2.0
   48    41    44    51   1.50000 -1.0 2.0
   48    53    57    58  -0.05950  1.0 1.0
   48    53    57    58   0.08850 -1.0 2.0
   48    53    57    58   0.11750  1.0 3.0
   48    53    57    59  -0.05950  1.0 1.0
   48    53    57    59   0.08850 -1.0 2.0
   48    53    57    59   0.11750  1.0 3.0
   48    53    60    61   0.00000  1.0 1.0
   48    53    60    64   0.50000  1.0 1.0
   48    53    60    64   0.27300 -1.0 2.0
   48    53    60    64   0.22500  1.0 3.0
   49    48    53    54   0.15000  1.0 3.0
   49    48    53    57   0.15000  1.0 3.0
   49    48    53    60  -0.03800  1.0 3.0
   50    48    53    54   0.15000  1.0 3.0
   50    48    53    57   0.15000  1.0 3.0
   50    48    53    60  -0.03800  1.0 3.0
   53    60    64    65   1.50000  1.0 1.0
   53    60    64    65   2.45000 -1.0 2.0
   54    53    57    58   0.20000  1.0 3.0
   54    53    57    59   0.20000  1.0 3.0
   54    53    60    61   0.00000  1.0 1.0
   54    53    60    64   0.00000  1.0 1.0
   57    53    60    61   0.30150 -1.0 2.0
   57    53    60    64   0.40000  1.0 3.0
   60    53    57    58   0.21900  1.0 1.0
   60    53    57    58  -0.24900 -1.0 2.0
   60    53    57    58   0.15200  1.0 3.0
   60    53    57    59   0.21900  1.0 1.0
   60    53    57    59  -0.24900 -1.0 2.0
   60    53    57    59   0.15200  1.0 3.0
   61    60    64    65   0.92200  1.0 1.0
   61    60    64    65   3.74100 -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
   48    44    41    37   1.10000 -1.0 2.0
   41    51    44    45  10.50000 -1.0 2.0
   44    55    51    52  10.50000 -1.0 2.0
   39    46    42    43  10.50000 -1.0 2.0
   66    73    71    72  10.50000 -1.0 2.0
   53    64    60    61  10.50000 -1.0 2.0
END
