* LIGAND DATABASE FILE (OPLS2005)
*
001      75    77    145    237     440
    1     0 S   NP   _N1_     1    29.56515    96.44973   -17.66329
    2     1 S   H    _HN1     2     1.02779    70.97233   -98.30725
    3     1 S   H    _H1_     3     1.02960    82.74364    13.97977
    4     1 S   H    _H2_     4     1.02839    54.11613   131.12100
    5     1 S   CT   _CA1     5     1.50124   163.38768   157.46319
    6     5 S   HC   _HA1     6     1.09563   105.26395    36.64503
    7     5 S   CO3  _C1_     7     1.53829   112.34378   -83.70870
    8     7 S   O2Z  _O11     8     1.26365   114.97831   -42.60734
    9     7 S   O2Z  _O12     9     1.26221   114.95878   136.53769
   10     5 S   CT   _CB1    10     1.53069   107.43852   154.74489
   11    10 S   HC   HB11    11     1.09822   109.54537   -48.71527
   12    10 S   HC   HB12    12     1.09822   110.31101    67.86102
   13    10 S   CT   _CG1    13     1.53016   112.65341  -169.73053
   14    13 S   HC   HG11    14     1.09558   110.50212   -59.67188
   15    13 S   HC   HG12    15     1.09630   110.07881    59.50126
   16    13 S   C    _CD1    16     1.51786   112.11116   179.76097
   17    16 S   O    _OE1    17     1.22724   123.19475    -8.22779
   18    16 S   N    _N2_    18     1.38569   111.70758   172.12204
   19    18 S   H    _HN2    19     1.01584   119.06707     3.02297
   20    18 S   CT1  _CA2    20     1.46002   123.49731  -178.04025
   21    20 S   HC   _HA2    21     1.09730   109.32383    -1.28862
   22    20 S   C    _C2_    22     1.53584   108.52158  -116.76962
   23    22 S   O    _O2_    23     1.23043   122.20827  -146.34216
   24    20 S   CT   _CB2    32     1.53474   111.86483   120.59192
   25    24 S   HC   HB21    33     1.09513   110.88488    58.08458
   26    24 S   HC   HB22    34     1.09572   109.57957   175.54078
   27    22 S   N    _N3_    24     1.38505   113.59707    41.10120
   28    27 S   H    _HN3    25     1.01487   118.95762    -0.54321
   29    24 S   S    _SG2    35     1.83112   113.03224   -66.50884
   30    27 S   CT   _CA3    26     1.45453   123.51866   175.33721
   31    30 S   HC   HA31    27     1.09517   109.36326    22.40932
   32    30 S   HC   HA32    28     1.09501   107.09451   139.40461
   33    29 S   CT   _C12    36     1.84889   100.27084    96.19894
   34    33 S   HC   _H8_    37     1.09520   105.32708   -48.49641
   35    30 S   CO3  _C3_    29     1.52904   113.00671  -101.17069
   36    35 S   O2Z  _O31    30     1.26410   115.34667   -46.41986
   37    35 S   O2Z  _O32    31     1.26349   115.02983   134.52016
   38    33 S   CT   _C11    38     1.56725   114.55053  -165.07070
   39    38 S   HC   _H7_    39     1.09884   105.56878   -47.61048
   40    38 S   CT   _C5_    40     1.55214   117.04369    71.77218
   41    40 S   HC   _H3_    41     1.09672   108.62509    49.71897
   42    38 S   CT   _C10    58     1.57297   103.20958  -161.35556
   43    40 S   CT   _C6_    42     1.54088   113.17101   168.27413
   44    43 S   HC   _H14    43     1.09941   109.68133   166.45967
   45    43 S   HC   _H15    44     1.09601   109.83328   -81.99001
   46    42 S   CT   _C14    59     1.55247    99.13336    44.82069
   47    46 S   HC   _H10    60     1.10090   108.60054    77.54478
   48    42 S   CT   _C15    66     1.55375   112.97508   -71.20783
   49    48 S   HC   _H17    67     1.09620   110.86855   176.68932
   50    48 S   HC   _H18    68     1.09335   113.16028    56.40966
   51    48 S   HC   _H19    69     1.09400   111.60735   -64.22271
   52    40 S   CT   _C4_    72     1.53544   113.44870   -68.41720
   53    52 S   HC   _H11    73     1.09465   111.63015   -49.36438
   54    52 S   HC   _H12    74     1.09594   111.29641  -169.77138
   55    52 S   HC   _H13    75     1.09086   111.46814    72.82915
   56    43 S   CT   _C7_    45     1.53334   116.13267    43.30046
   57    56 S   HC   _H4_    46     1.09741   109.61491    61.18050
   58    33 S   CT   _C13    61     1.57652   116.89075    70.68334
   59    58 S   OM   _O34    62     1.32338   114.04083    18.11929
   60    58 S   HC   _H9_    63     1.10074   105.70702  -113.73157
   61    46 S   OH   _O33    64     1.42306   112.80733  -163.77132
   62    61 S   HO   _H16    65     0.97317   106.27424   170.36499
   63    56 S   CT   _C8_    47     1.53776   117.51783   -65.71006
   64    63 S   HC   _H5_    48     1.09664   110.73744   106.16316
   65    63 S   CM   _C16    49     1.49450   100.21439  -139.59900
   66    63 S   CT   _C9_    56     1.54401   113.43510   -17.29449
   67    66 S   HC   _H6_    57     1.09650   107.76329   -48.77766
   68    65 S   CO4  _C18    50     1.47014   110.03636    18.88136
   69    68 S   O    _O36    51     1.21740   127.15042   170.29005
   70    65 S   CM   _C17    53     1.33651   128.42046  -157.00769
   71    70 S   HC   _H21    54     1.08479   120.84147    -2.07830
   72    70 S   HC   _H22    55     1.08510   121.79856   177.86027
   73    66 S   OH   _O35    70     1.43112   110.51368  -161.35143
   74    73 S   HO   _H20    71     0.97124   108.47383   -59.12624
   75    56 S   OS   _O37    52     1.44859   105.93824   175.73515
  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  10   5   4   3
  16   8   2   1   1  26   9  17   9  21  14   6   5  14   7   9
   3   2   1   4   2   1   1  11   6   5   2   1   2   1  12   7
   9   6   2   5   2   3   1   1   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    58    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    42    46    58    59    60  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    43    66    42    46    47    58    59    60    61    48    52  
   38    39    40    42    46    58    59    60  
   36    37  
   37  
    0  
   39    40    41    43    44    45    56    63    66    67    42    46    47    58    59    60    61    48    49    50    51    73    52    53    54    55  
   40    41    43    66    42    46    58    48    52  
   41    43    44    45    56    57    63    75    66    42    46    58    48    52    53    54    55  
   43    44    45    56    42    52    53    54    55  
   46    47    58    59    60    61    62    48    49    50    51    73    74    52    43    56    63    64    65    66    67  
   44    45    56    57    63    64    65    68    75    66    52    53    54    55  
   45    56    57    63    75    52  
   56    57    63    75    52  
   47    58    59    60    61    62    48    49    50    51    73    63    66    67  
   58    59    60    61    62    48    66  
   49    50    51    73    58    61    63    66    67  
   50    51    66  
   51    66  
   66  
   53    54    55    56  
   54    55  
   55  
    0  
   57    63    64    65    68    69    75    70    66    67    73  
   63    64    65    68    75    66  
   59    60    61    62    66  
   60    61  
   61  
   62    66  
    0  
   64    65    68    69    75    70    71    72    66    67    73    74  
   65    68    75    70    66    67    73  
   68    69    75    70    71    72    66    67    73  
   67    73    74    68    70    75  
   73    74  
   69    75    70    71    72  
   75    70  
   71    72    75  
   72  
    0  
   74  
    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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.180000   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   2.5000   0.0300   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   58   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   59   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   60   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   66   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   70   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   71   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   72   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   73   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   74   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   75   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
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   268.000  1.529
   33    58   268.000  1.529
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    42   268.000  1.529
   40    41   340.000  1.090
   40    43   268.000  1.529
   40    52   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    56   268.000  1.529
   56    57   340.000  1.090
   56    63   268.000  1.529
   56    75   320.000  1.410
   63    64   340.000  1.090
   63    65   317.000  1.510
   63    66   268.000  1.529
   65    68   320.000  1.462
   65    70   549.000  1.340
   68    69   570.000  1.229
   68    75   214.000  1.327
   70    71   340.000  1.080
   70    72   340.000  1.080
   66    67   340.000  1.090
   66    42   268.000  1.529
   66    73   320.000  1.410
   42    46   268.000  1.529
   42    48   268.000  1.529
   46    47   340.000  1.090
   46    58   268.000  1.529
   46    61   320.000  1.410
   58    59   570.000  1.307
   58    60   340.000  1.090
   61    62   553.000  0.945
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   340.000  1.090
   73    74   553.000  0.945
   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    75.00000  111.63000
   29    33    58    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    42    58.35000  112.70000
   33    58    46    58.35000  112.70000
   33    58    59    50.00000  109.50000
   33    58    60    37.50000  110.70000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    43    58.35000  112.70000
   38    40    52    58.35000  112.70000
   38    42    66    58.35000  112.70000
   38    42    46    58.35000  112.70000
   38    42    48    58.35000  112.70000
   40    38    39    37.50000  110.70000
   40    43    44    37.50000  110.70000
   40    43    45    37.50000  110.70000
   40    43    56    58.35000  112.70000
   40    52    53    37.50000  110.70000
   40    52    54    37.50000  110.70000
   40    52    55    37.50000  110.70000
   43    40    41    37.50000  110.70000
   43    56    57    37.50000  110.70000
   43    56    63    58.35000  112.70000
   43    56    75    50.00000  109.50000
   45    43    44    33.00000  107.80000
   56    43    44    37.50000  110.70000
   56    43    45    37.50000  110.70000
   56    63    64    37.50000  110.70000
   56    63    65    70.00000  112.02700
   56    63    66    58.35000  112.70000
   56    75    68    83.00000  116.90000
   63    56    57    37.50000  110.70000
   63    65    68    65.00000  116.34900
   63    65    70    70.00000  124.00000
   63    66    67    37.50000  110.70000
   63    66    42    58.35000  112.70000
   63    66    73    50.00000  109.50000
   65    63    64    35.00000  109.50000
   65    68    69    80.00000  123.72100
   65    68    75    90.00000  111.29400
   65    70    71    35.00000  120.00000
   65    70    72    35.00000  120.00000
   75    56    57    35.00000  109.50000
   75    56    63    50.00000  109.50000
   75    68    69    83.00000  123.40000
   70    65    68    65.00000  118.96000
   72    70    71    35.00000  117.00000
   66    63    64    37.50000  110.70000
   66    63    65    70.00000  112.02700
   66    42    46    58.35000  112.70000
   66    42    48    58.35000  112.70000
   66    73    74    55.00000  108.50000
   42    38    39    37.50000  110.70000
   42    38    40    58.35000  112.70000
   42    66    67    37.50000  110.70000
   42    46    47    37.50000  110.70000
   42    46    58    58.35000  112.70000
   42    46    61    50.00000  109.50000
   42    48    49    37.50000  110.70000
   42    48    50    37.50000  110.70000
   42    48    51    37.50000  110.70000
   46    58    59    50.00000  109.50000
   46    58    60    37.50000  110.70000
   46    61    62    55.00000  108.50000
   58    33    34    37.50000  110.70000
   58    33    38    58.35000  112.70000
   58    46    47    37.50000  110.70000
   60    58    59    45.00000  125.66300
   61    46    47    35.00000  109.50000
   61    46    58    50.00000  109.50000
   48    42    46    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    33.00000  107.80000
   73    66    67    35.00000  109.50000
   73    66    42    50.00000  109.50000
   52    40    41    37.50000  110.70000
   52    40    43    58.35000  112.70000
   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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    58   0.01700  1.0 1.0
   24    29    33    58  -0.23550 -1.0 2.0
   24    29    33    58   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   0.15000  1.0 3.0
   29    33    38    40   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  1.0 3.0
   29    33    38    42   0.44750  1.0 1.0
   29    33    38    42  -0.17800 -1.0 2.0
   29    33    38    42   0.20200  1.0 3.0
   29    33    58    46   0.44750  1.0 1.0
   29    33    58    46  -0.17800 -1.0 2.0
   29    33    58    46   0.20200  1.0 3.0
   29    33    58    59   0.56750  1.0 1.0
   29    33    58    59  -0.07550 -1.0 2.0
   29    33    58    59   0.20000  1.0 3.0
   29    33    58    60   0.15000  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    43   0.56750  1.0 1.0
   33    38    40    43  -0.07550 -1.0 2.0
   33    38    40    43   0.20000  1.0 3.0
   33    38    40    52   0.56750  1.0 1.0
   33    38    40    52  -0.07550 -1.0 2.0
   33    38    40    52   0.20000  1.0 3.0
   33    38    42    66   0.56750  1.0 1.0
   33    38    42    66  -0.07550 -1.0 2.0
   33    38    42    66   0.20000  1.0 3.0
   33    38   -42    46   0.56750  1.0 1.0
   33    38   -42    46  -0.07550 -1.0 2.0
   33    38   -42    46   0.20000  1.0 3.0
   33    38    42    48   0.56750  1.0 1.0
   33    38    42    48  -0.07550 -1.0 2.0
   33    38    42    48   0.20000  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    42   0.15000  1.0 3.0
   34    33    58    46   0.15000  1.0 3.0
   34    33    58    59   0.23400  1.0 3.0
   34    33    58    60   0.15000  1.0 3.0
   38    33   -58    46   0.56750  1.0 1.0
   38    33   -58    46  -0.07550 -1.0 2.0
   38    33   -58    46   0.20000  1.0 3.0
   38    33    58    59   0.62750  1.0 1.0
   38    33    58    59  -0.30950 -1.0 2.0
   38    33    58    59   0.27300  1.0 3.0
   38    33    58    60   0.15000  1.0 3.0
   38    40    43    44   0.15000  1.0 3.0
   38    40    43    45   0.15000  1.0 3.0
   38    40    43    56   0.56750  1.0 1.0
   38    40    43    56  -0.07550 -1.0 2.0
   38    40    43    56   0.20000  1.0 3.0
   38    40    52    53   0.15000  1.0 3.0
   38    40    52    54   0.15000  1.0 3.0
   38    40    52    55   0.15000  1.0 3.0
   38    42    46    47   0.15000  1.0 3.0
   38    42   -46    58   0.56750  1.0 1.0
   38    42   -46    58  -0.07550 -1.0 2.0
   38    42   -46    58   0.20000  1.0 3.0
   38    42    46    61   0.86500  1.0 1.0
   38    42    46    61  -0.17500 -1.0 2.0
   38    42    46    61   0.20800  1.0 3.0
   38    42    48    49   0.15000  1.0 3.0
   38    42    48    50   0.15000  1.0 3.0
   38    42    48    51   0.15000  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    43   0.15000  1.0 3.0
   39    38    40    52   0.15000  1.0 3.0
   39    38    42    66   0.15000  1.0 3.0
   39    38    42    46   0.15000  1.0 3.0
   39    38    42    48   0.15000  1.0 3.0
   40    38    42    66   0.56750  1.0 1.0
   40    38    42    66  -0.07550 -1.0 2.0
   40    38    42    66   0.20000  1.0 3.0
   40    38    42    46   0.56750  1.0 1.0
   40    38    42    46  -0.07550 -1.0 2.0
   40    38    42    46   0.20000  1.0 3.0
   40    38    42    48   0.56750  1.0 1.0
   40    38    42    48  -0.07550 -1.0 2.0
   40    38    42    48   0.20000  1.0 3.0
   40    43    56    57   0.15000  1.0 3.0
   40    43    56    63   0.56750  1.0 1.0
   40    43    56    63  -0.07550 -1.0 2.0
   40    43    56    63   0.20000  1.0 3.0
   40    43    56    75   0.62750  1.0 1.0
   40    43    56    75  -0.30950 -1.0 2.0
   40    43    56    75   0.27300  1.0 3.0
   41    40    43    44   0.15000  1.0 3.0
   41    40    43    45   0.15000  1.0 3.0
   41    40    43    56   0.15000  1.0 3.0
   41    40    52    53   0.15000  1.0 3.0
   41    40    52    54   0.15000  1.0 3.0
   41    40    52    55   0.15000  1.0 3.0
   43    40    52    53   0.15000  1.0 3.0
   43    40    52    54   0.15000  1.0 3.0
   43    40    52    55   0.15000  1.0 3.0
   43    56    63    64   0.15000  1.0 3.0
   43    56    63    65   0.34400  1.0 1.0
   43    56    63    65   0.09450 -1.0 2.0
   43    56    63    65   0.11100  1.0 3.0
   43    56    63    66   0.56750  1.0 1.0
   43    56    63    66  -0.07550 -1.0 2.0
   43    56    63    66   0.20000  1.0 3.0
   43    56    75    68  -0.25900  1.0 1.0
   43    56    75    68  -0.47000 -1.0 2.0
   43    56    75    68   0.11750  1.0 3.0
   44    43    56    57   0.15000  1.0 3.0
   44    43    56    63   0.15000  1.0 3.0
   44    43    56    75   0.23400  1.0 3.0
   45    43    56    57   0.15000  1.0 3.0
   45    43    56    63   0.15000  1.0 3.0
   45    43    56    75   0.23400  1.0 3.0
   56    63   -65    68   0.09700  1.0 1.0
   56    63   -65    68   0.15600 -1.0 2.0
   56    63   -65    68  -0.50800  1.0 3.0
   56    63    65    70   0.09850  1.0 1.0
   56    63    65    70   0.15250 -1.0 2.0
   56    63    65    70  -0.50650  1.0 3.0
   56    63    66    67   0.15000  1.0 3.0
   56    63    66    42   0.56750  1.0 1.0
   56    63    66    42  -0.07550 -1.0 2.0
   56    63    66    42   0.20000  1.0 3.0
   56    63    66    73   0.86500  1.0 1.0
   56    63    66    73  -0.17500 -1.0 2.0
   56    63    66    73   0.20800  1.0 3.0
   57    56    63    64   0.15000  1.0 3.0
   57    56    63    65   0.15000  1.0 3.0
   57    56    63    66   0.15000  1.0 3.0
   57    56    75    68   0.08050  1.0 3.0
   63    56   -75    68  -0.25900  1.0 1.0
   63    56   -75    68  -0.47000 -1.0 2.0
   63    56   -75    68   0.11750  1.0 3.0
   63    65    68    69  -0.64400  1.0 1.0
   63    65    68    69   0.26850 -1.0 2.0
   63    65   -68    75  -0.15000  1.0 1.0
   63    65   -68    75   0.89550 -1.0 2.0
   63    65   -68    75  -0.06900  1.0 3.0
   63    65    70    71   7.00000 -1.0 2.0
   63    65    70    72   7.00000 -1.0 2.0
   63    66    42    38   0.56750  1.0 1.0
   63    66    42    38  -0.07550 -1.0 2.0
   63    66    42    38   0.20000  1.0 3.0
   63    66    42    46   0.56750  1.0 1.0
   63    66    42    46  -0.07550 -1.0 2.0
   63    66    42    46   0.20000  1.0 3.0
   63    66    42    48   0.56750  1.0 1.0
   63    66    42    48  -0.07550 -1.0 2.0
   63    66    42    48   0.20000  1.0 3.0
   63    66    73    74  -0.11600  1.0 1.0
   63    66    73    74  -0.09450 -1.0 2.0
   63    66    73    74   0.21250  1.0 3.0
   64    63    65    68   0.15000  1.0 3.0
   64    63    65    70   0.00000  1.0 1.0
   64    63    66    67   0.15000  1.0 3.0
   64    63    66    42   0.15000  1.0 3.0
   64    63    66    73   0.23400  1.0 3.0
   65    63    66    67   0.15000  1.0 3.0
   65    63    66    42   0.34400  1.0 1.0
   65    63    66    42   0.09450 -1.0 2.0
   65    63    66    42   0.11100  1.0 3.0
   65    63    66    73   1.05650  1.0 1.0
   65    63    66    73   0.15600 -1.0 2.0
   65    63    66    73   0.53150  1.0 3.0
   65    68   -75    56   2.00000 -1.0 2.0
   68    65    70    71   7.00000 -1.0 2.0
   68    65    70    72   7.00000 -1.0 2.0
   69    68    75    56   3.00000 -1.0 2.0
   75    56    63    64   0.23400  1.0 3.0
   75    56   -63    65   0.61850  1.0 1.0
   75    56   -63    65  -0.22750 -1.0 2.0
   75    56   -63    65   0.15300  1.0 3.0
   75    56    63    66   0.62750  1.0 1.0
   75    56    63    66  -0.30950 -1.0 2.0
   75    56    63    66   0.27300  1.0 3.0
   70    65    68    69   1.00000 -1.0 2.0
   70    65    68    75  -0.56150  1.0 1.0
   70    65    68    75   2.19150 -1.0 2.0
   66    63    65    68   0.09700  1.0 1.0
   66    63    65    68   0.15600 -1.0 2.0
   66    63    65    68  -0.50800  1.0 3.0
   66    63    65    70   0.09850  1.0 1.0
   66    63    65    70   0.15250 -1.0 2.0
   66    63    65    70  -0.50650  1.0 3.0
   66    42    46    47   0.15000  1.0 3.0
   66    42    46    58   0.56750  1.0 1.0
   66    42    46    58  -0.07550 -1.0 2.0
   66    42    46    58   0.20000  1.0 3.0
   66    42    46    61   0.86500  1.0 1.0
   66    42    46    61  -0.17500 -1.0 2.0
   66    42    46    61   0.20800  1.0 3.0
   66    42    48    49   0.15000  1.0 3.0
   66    42    48    50   0.15000  1.0 3.0
   66    42    48    51   0.15000  1.0 3.0
   67    66    42    38   0.15000  1.0 3.0
   67    66    42    46   0.15000  1.0 3.0
   67    66    42    48   0.15000  1.0 3.0
   67    66    73    74   0.19450  1.0 3.0
   42    38    40    41   0.15000  1.0 3.0
   42    38    40    43   0.56750  1.0 1.0
   42    38    40    43  -0.07550 -1.0 2.0
   42    38    40    43   0.20000  1.0 3.0
   42    38    40    52   0.56750  1.0 1.0
   42    38    40    52  -0.07550 -1.0 2.0
   42    38    40    52   0.20000  1.0 3.0
   42    66    73    74  -0.11600  1.0 1.0
   42    66    73    74  -0.09450 -1.0 2.0
   42    66    73    74   0.21250  1.0 3.0
   42    46   -58    33   0.56750  1.0 1.0
   42    46   -58    33  -0.07550 -1.0 2.0
   42    46   -58    33   0.20000  1.0 3.0
   42    46    58    59   0.62750  1.0 1.0
   42    46    58    59  -0.30950 -1.0 2.0
   42    46    58    59   0.27300  1.0 3.0
   42    46    58    60   0.15000  1.0 3.0
   42    46    61    62  -0.11600  1.0 1.0
   42    46    61    62  -0.09450 -1.0 2.0
   42    46    61    62   0.21250  1.0 3.0
   46    42    48    49   0.15000  1.0 3.0
   46    42    48    50   0.15000  1.0 3.0
   46    42    48    51   0.15000  1.0 3.0
   47    46    58    33   0.15000  1.0 3.0
   47    46    58    59   0.23400  1.0 3.0
   47    46    58    60   0.15000  1.0 3.0
   47    46    61    62   0.19450  1.0 3.0
   58    33    38    39   0.15000  1.0 3.0
   58    33    38    40   0.56750  1.0 1.0
   58    33    38    40  -0.07550 -1.0 2.0
   58    33    38    40   0.20000  1.0 3.0
   58    33   -38    42   0.56750  1.0 1.0
   58    33   -38    42  -0.07550 -1.0 2.0
   58    33   -38    42   0.20000  1.0 3.0
   58    46    61    62  -0.11600  1.0 1.0
   58    46    61    62  -0.09450 -1.0 2.0
   58    46    61    62   0.21250  1.0 3.0
   61    46    58    33   0.86500  1.0 1.0
   61    46    58    33  -0.17500 -1.0 2.0
   61    46    58    33   0.20800  1.0 3.0
   61    46    58    59   3.69350  1.0 1.0
   61    46    58    59  -1.82950 -1.0 2.0
   61    46    58    60   0.23400  1.0 3.0
   48    42    46    47   0.15000  1.0 3.0
   48    42    46    58   0.56750  1.0 1.0
   48    42    46    58  -0.07550 -1.0 2.0
   48    42    46    58   0.20000  1.0 3.0
   48    42    46    61   0.86500  1.0 1.0
   48    42    46    61  -0.17500 -1.0 2.0
   48    42    46    61   0.20800  1.0 3.0
   73    66    42    38   0.86500  1.0 1.0
   73    66    42    38  -0.17500 -1.0 2.0
   73    66    42    38   0.20800  1.0 3.0
   73    66    42    46   0.86500  1.0 1.0
   73    66    42    46  -0.17500 -1.0 2.0
   73    66    42    46   0.20800  1.0 3.0
   73    66    42    48   0.86500  1.0 1.0
   73    66    42    48  -0.17500 -1.0 2.0
   73    66    42    48   0.20800  1.0 3.0
   52    40    43    44   0.15000  1.0 3.0
   52    40    43    45   0.15000  1.0 3.0
   52    40    43    56   0.56750  1.0 1.0
   52    40    43    56  -0.07550 -1.0 2.0
   52    40    43    56   0.20000  1.0 3.0
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
   63    68    65    70   1.10000 -1.0 2.0
   65    75    68    69  10.50000 -1.0 2.0
   71    72    70    65   1.10000 -1.0 2.0
END
