* LIGAND DATABASE FILE (OPLS2005)
*
001      73    73    129    193     384
    1     0 S   NP   _N1_     1    29.15470    92.96588   -20.08989
    2     1 S   H    _HN1     2     1.02787    81.29942   -87.85792
    3     1 S   H    _H1_     3     1.02960   102.89693    18.92626
    4     1 S   H    _H2_     4     1.02835    30.34067   120.98150
    5     1 S   CT   _CA1     5     1.50115   136.72734   158.99576
    6     5 S   HC   _HA1     6     1.09583   105.27740    40.20792
    7     5 S   CO3  _C1_     7     1.53836   112.16532   -79.88809
    8     7 S   O2Z  _O11     8     1.26393   115.16135   -51.02985
    9     7 S   O2Z  _O12     9     1.26231   114.88917   128.15415
   10     5 S   CT   _CB1    10     1.53061   107.30633   157.82779
   11    10 S   HC   HB11    11     1.09816   109.35564   -52.49887
   12    10 S   HC   HB12    12     1.09771   110.27527    63.88479
   13    10 S   CT   _CG1    13     1.53009   112.75187  -173.81312
   14    13 S   HC   HG11    14     1.09596   110.16603   -59.80830
   15    13 S   HC   HG12    15     1.09605   110.32011    59.35913
   16    13 S   C    _CD1    16     1.51792   111.92204   179.46478
   17    16 S   O    _OE1    17     1.22742   123.11932   -18.68128
   18    16 S   N    _N2_    18     1.38591   111.89643   162.29584
   19    18 S   H    _HN2    19     1.01557   119.18657     4.02088
   20    18 S   CT1  _CA2    20     1.46114   123.24886  -174.99234
   21    20 S   HC   _HA2    21     1.09591   109.21434    -0.66940
   22    20 S   C    _C2_    22     1.53345   108.98614  -116.25487
   23    22 S   O    _O2_    23     1.23043   122.15540  -144.71910
   24    20 S   CT   _CB2    32     1.53485   111.30974   121.13630
   25    24 S   HC   HB21    33     1.09655   109.58183    63.87610
   26    24 S   HC   HB22    34     1.09563   111.11254  -178.55734
   27    22 S   N    _N3_    24     1.38485   113.54068    42.73731
   28    27 S   H    _HN3    25     1.01498   118.99392    -0.30132
   29    24 S   S    _SG2    35     1.82749   113.85473   -55.30988
   30    27 S   CT   _CA3    26     1.45431   123.24476   175.01866
   31    30 S   HC   HA31    27     1.09538   108.99473    29.10129
   32    30 S   HC   HA32    28     1.09489   107.18476   146.07195
   33    29 S   CT   _C11    36     1.82572    99.84137   -74.81803
   34    33 S   HC   _H3_    37     1.09148   109.84507    47.48263
   35    33 S   HC   _H4_    38     1.09521   108.52159   -68.17799
   36    30 S   CO3  _C3_    29     1.52946   113.27539   -94.19856
   37    36 S   O2Z  _O31    30     1.26390   115.48377   -43.05151
   38    36 S   O2Z  _O32    31     1.26368   114.93442   137.88650
   39    33 S   CM   _C4_    39     1.52501   110.04813   169.48822
   40    39 S   CMA  _C5_    40     1.36886   121.64153    87.32209
   41    40 S   OM   _O33    41     1.26902   125.89859     3.47457
   42    39 S   CT   _C14    65     1.53108   115.45023   -93.33387
   43    42 S   HC   _H33    66     1.09390   112.18468   178.77124
   44    40 S   OS1  _O20    42     1.41593   113.29680  -177.83698
   45    42 S   CT   _C13    67     1.53208   113.21966   -59.94647
   46    45 S   HC   _H31    68     1.09472   111.23581   -44.43564
   47    45 S   HC   _H32    69     1.09411   111.81029    78.60053
   48    42 S   OH   _O19    72     1.42929   109.74929    61.73977
   49    48 S   HO   _H39    73     0.97462   106.94311    55.52676
   50    44 S   CO1  _C10    43     1.44470   111.27083   100.91300
   51    50 S   HC   _H26    44     1.09928   110.26223    38.33266
   52    45 S   OH   _O18    70     1.42769   109.23259  -163.03377
   53    52 S   HO   _H38    71     0.97225   106.82614  -178.30973
   54    50 S   CT   _C8_    45     1.53369   107.55662   157.65111
   55    54 S   HC   _H24    46     1.09672   110.11974    53.24828
   56    54 S   CT   _C6_    47     1.53169   110.77278   175.04247
   57    56 S   HC   _H22    48     1.09668   110.20234    73.04458
   58    54 S   OH5  _O16    63     1.42909   110.37837   -63.88396
   59    58 S   HO   _H36    64     0.97252   108.14499   -50.56014
   60    56 S   CT   _C7_    49     1.53277   111.43808   -49.74602
   61    60 S   HC   _H23    50     1.09712   108.89046   -71.83120
   62    56 S   OH5  _O14    61     1.43014   109.65458  -171.08075
   63    62 S   HO   _H34    62     0.97237   108.04130    59.60573
   64    60 S   CT   _C9_    51     1.53231   111.00454    49.42206
   65    64 S   HC   _H25    52     1.09805   111.15213    65.76036
   66    60 S   OH5  _O15    59     1.42626   109.71144   171.49255
   67    66 S   HO   _H35    60     0.97257   108.09116   -59.23697
   68    50 S   OS1  _O13    53     1.43081   110.31132   -83.12159
   69    64 S   CT   _C12    54     1.53032   111.44739  -173.15897
   70    69 S   HC   _H29    55     1.09522   110.85748    67.08583
   71    69 S   HC   _H30    56     1.09393   111.56849   -55.19109
   72    69 S   OH5  _O17    57     1.42506   109.17714  -174.45553
   73    72 S   HO   _H37    58     0.97635   106.73897  -175.12967
  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   6   5   4   3
  10   4   3   2   1   1  12  10   3   9   6   8   6   4   3   2
   1  13   6   1   1  12   7  13   7   4   1  12   7   3   1   9
   6   3   1   4   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    42  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    44    42    43    45    48  
   35    39    40    42  
   39    40    42  
   37    38  
   38  
    0  
   40    41    44    50    42    43    45    46    47    52    48    49  
   41    44    50    51    54    68    42    43    45    48  
   44    50    42  
   43    45    46    47    52    53    48    49    44  
   45    46    47    52    48    49  
   50    51    54    55    56    64    68    58  
   46    47    52    53    48    49  
   47    52    53    48  
   52    53    48  
   49    52  
    0  
   51    54    55    56    57    60    64    65    68    69    62    58    59  
   54    55    56    64    68    58  
   53  
    0  
   55    56    57    60    61    64    68    66    62    63    58    59  
   56    57    60    68    62    58    59  
   57    60    61    64    65    68    69    66    67    62    63    58    59  
   60    61    64    66    62    63    58  
   59    60    62    68  
    0  
   61    64    65    68    69    70    71    72    66    67    62    63  
   64    65    68    69    66    67    62  
   63    64    66  
    0  
   65    68    69    70    71    72    73    66    67  
   68    69    70    71    72    66  
   67    68    69  
    0  
   69    70    71    72  
   70    71    72    73  
   71    72    73  
   72    73  
   73  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.9000   0.1400  -0.685000   1.7660   1.5600   0.020110767  -0.896042159
   45   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   52   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   54   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   60   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   63   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   64   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   66   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   67   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   68   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   69   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   73   0.5000   0.0300   0.418000   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   317.000  1.510
   39    40   465.000  1.376
   39    42   317.000  1.510
   40    41   745.000  1.250
   40    44   440.000  1.360
   44    50   370.000  1.399
   50    51   360.000  1.097
   50    54   255.000  1.525
   50    68   370.000  1.399
   54    55   340.000  1.090
   54    56   268.000  1.529
   54    58   355.000  1.421
   56    57   340.000  1.090
   56    60   268.000  1.529
   56    62   355.000  1.421
   60    61   340.000  1.090
   60    64   268.000  1.529
   60    66   355.000  1.421
   64    65   340.000  1.090
   64    68   335.000  1.422
   64    69   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   355.000  1.421
   72    73   580.000  0.967
   66    67   580.000  0.967
   62    63   580.000  0.967
   58    59   580.000  0.967
   42    43   340.000  1.090
   42    45   268.000  1.529
   42    48   320.000  1.410
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    52   320.000  1.410
   52    53   553.000  0.945
   48    49   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  112.20000
   33    39    40    70.00000  124.00000
   33    39    42    65.00000  117.92700
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    40    41    65.00000  137.10300
   39    40    44    80.00000  120.01400
   39    42    43    35.00000  109.50000
   39    42    45    70.00000  112.02700
   39    42    48    90.00000  110.39200
   40    44    50    90.00000  111.18400
   44    40    41    65.00000  121.00000
   44    50    51    60.00000  105.75400
   44    50    54    90.00000  109.70700
   44    50    68   110.00000  113.16000
   50    54    55    45.00000  109.54000
   50    54    56    70.00000  111.10000
   50    54    58    90.00000  109.42000
   50    68    64    90.00000  112.10700
   54    50    51    45.00000  111.65000
   54    56    57    37.50000  110.70000
   54    56    60    58.35000  112.70000
   54    56    62    90.00000  111.45300
   54    58    59    65.00000  108.53500
   56    54    55    37.50000  110.70000
   56    60    61    37.50000  110.70000
   56    60    64    58.35000  112.70000
   56    60    66    90.00000  111.45300
   56    62    63    65.00000  108.53500
   60    56    57    37.50000  110.70000
   60    64    65    37.50000  110.70000
   60    64    68    95.00000  107.88500
   60    64    69    58.35000  112.70000
   60    66    67    65.00000  108.53500
   64    60    61    37.50000  110.70000
   64    69    70    37.50000  110.70000
   64    69    71    37.50000  110.70000
   64    69    72    90.00000  111.45300
   68    50    51    60.00000  105.75400
   68    50    54    90.00000  109.70700
   68    64    65    55.00000  108.98800
   69    64    65    37.50000  110.70000
   69    64    68    95.00000  107.88500
   69    72    73    65.00000  108.53500
   71    69    70    33.00000  107.80000
   72    69    70    60.00000  109.39000
   72    69    71    60.00000  109.39000
   66    60    61    60.00000  109.39000
   66    60    64    90.00000  111.45300
   62    56    57    60.00000  109.39000
   62    56    60    90.00000  111.45300
   58    54    55    60.00000  109.39000
   58    54    56    90.00000  111.45300
   42    39    40    70.00000  124.00000
   42    45    46    37.50000  110.70000
   42    45    47    37.50000  110.70000
   42    45    52    50.00000  109.50000
   42    48    49    55.00000  108.50000
   45    42    43    37.50000  110.70000
   45    52    53    55.00000  108.50000
   47    45    46    33.00000  107.80000
   52    45    46    35.00000  109.50000
   52    45    47    35.00000  109.50000
   48    42    43    35.00000  109.50000
   48    42    45    50.00000  109.50000
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40   0.42700  1.0 1.0
   29    33    39    40  -0.70350 -1.0 2.0
   29    33    39    40  -0.43150  1.0 3.0
   29    33    39    42   0.30250  1.0 1.0
   29    33    39    42  -0.14950 -1.0 2.0
   29    33    39    42   0.36900  1.0 3.0
   33    39    40    41   7.00000 -1.0 2.0
   33    39    40    44   7.00000 -1.0 2.0
   33    39    42    43   0.34800  1.0 3.0
   33    39    42    45   0.46850  1.0 1.0
   33    39    42    45   0.08550 -1.0 2.0
   33    39    42    45   0.09800  1.0 3.0
   33    39    42    48   0.18000  1.0 1.0
   33    39    42    48   0.16450 -1.0 2.0
   33    39    42    48   0.04450  1.0 3.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    42   0.34800  1.0 3.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    42   0.34800  1.0 3.0
   39    40    44    50  -2.26850  1.0 1.0
   39    40    44    50   3.39050 -1.0 2.0
   39    42    45    46   0.15000  1.0 3.0
   39    42    45    47   0.15000  1.0 3.0
   39    42    45    52   1.05650  1.0 1.0
   39    42    45    52   0.15600 -1.0 2.0
   39    42    45    52   0.53150  1.0 3.0
   39    42    48    49  -0.07800  1.0 1.0
   39    42    48    49  -0.21500 -1.0 2.0
   39    42    48    49  -0.03150  1.0 3.0
   40    39    42    43   0.00000  1.0 1.0
   40    39    42    45   0.09850  1.0 1.0
   40    39    42    45   0.15250 -1.0 2.0
   40    39    42    45  -0.50650  1.0 3.0
   40    39    42    48   0.67800  1.0 1.0
   40    39    42    48   0.47050 -1.0 2.0
   40    39    42    48  -0.62500  1.0 3.0
   40    44    50    51   0.08050  1.0 3.0
   40    44    50    54  -0.46850  1.0 1.0
   40    44    50    54   0.09300 -1.0 2.0
   40    44    50    54  -0.12850  1.0 3.0
   40    44    50    68  -0.48150  1.0 1.0
   40    44    50    68   0.09250 -1.0 2.0
   40    44    50    68  -0.12850  1.0 3.0
   41    40    44    50   2.00000 -1.0 2.0
   44    50    54    55   0.23400  1.0 3.0
   44    50    54    56   0.62750  1.0 1.0
   44    50    54    56  -0.30950 -1.0 2.0
   44    50    54    56   0.27300  1.0 3.0
   44    50    54    58   1.51850  1.0 1.0
   44    50    68    64  -0.70400  1.0 1.0
   44    50    68    64  -0.90350 -1.0 2.0
   50    54    56    57   0.15000  1.0 3.0
   50    54    56    60   0.56750  1.0 1.0
   50    54    56    60  -0.07550 -1.0 2.0
   50    54    56    60   0.20000  1.0 3.0
   50    54    56    62  -0.47750  1.0 1.0
   50    54    58    59   0.29150  1.0 1.0
   50    54    58    59  -0.28350 -1.0 2.0
   50    54    58    59   0.43600  1.0 3.0
   51    50    54    55   0.15000  1.0 3.0
   51    50    54    56   0.15000  1.0 3.0
   51    50    54    58   0.23400  1.0 3.0
   51    50    68    64   0.37050  1.0 3.0
   54    50    68    64   0.06250  1.0 1.0
   54    50    68    64  -0.01100 -1.0 2.0
   54    50    68    64   0.28050  1.0 3.0
   54    56    60    61   0.15000  1.0 3.0
   54    56   -60    64   0.56750  1.0 1.0
   54    56   -60    64  -0.07550 -1.0 2.0
   54    56   -60    64   0.20000  1.0 3.0
   54    56    60    66  -0.47750  1.0 1.0
   54    56    62    63   0.29150  1.0 1.0
   54    56    62    63  -0.28350 -1.0 2.0
   54    56    62    63   0.43600  1.0 3.0
   55    54    56    57   0.15000  1.0 3.0
   55    54    56    60   0.15000  1.0 3.0
   55    54    56    62   0.23400  1.0 3.0
   55    54    58    59   0.19450  1.0 3.0
   56    54    58    59   0.29150  1.0 1.0
   56    54    58    59  -0.28350 -1.0 2.0
   56    54    58    59   0.43600  1.0 3.0
   56    60    64    65   0.15000  1.0 3.0
   56    60    64    68   0.62750  1.0 1.0
   56    60    64    68  -0.30950 -1.0 2.0
   56    60    64    68   0.27300  1.0 3.0
   56    60    64    69   0.56750  1.0 1.0
   56    60    64    69  -0.07550 -1.0 2.0
   56    60    64    69   0.20000  1.0 3.0
   56    60    66    67   0.29150  1.0 1.0
   56    60    66    67  -0.28350 -1.0 2.0
   56    60    66    67   0.43600  1.0 3.0
   57    56    60    61   0.15000  1.0 3.0
   57    56    60    64   0.15000  1.0 3.0
   57    56    60    66   0.23400  1.0 3.0
   57    56    62    63   0.19450  1.0 3.0
   60    56    62    63   0.29150  1.0 1.0
   60    56    62    63  -0.28350 -1.0 2.0
   60    56    62    63   0.43600  1.0 3.0
   60    64   -68    50   0.06250  1.0 1.0
   60    64   -68    50  -0.01100 -1.0 2.0
   60    64   -68    50   0.28050  1.0 3.0
   60    64    69    70   0.15000  1.0 3.0
   60    64    69    71   0.15000  1.0 3.0
   60    64    69    72  -0.47750  1.0 1.0
   61    60    64    65   0.15000  1.0 3.0
   61    60    64    68   0.23400  1.0 3.0
   61    60    64    69   0.15000  1.0 3.0
   61    60    66    67   0.19450  1.0 3.0
   64    60    66    67   0.29150  1.0 1.0
   64    60    66    67  -0.28350 -1.0 2.0
   64    60    66    67   0.43600  1.0 3.0
   64    69    72    73   0.29150  1.0 1.0
   64    69    72    73  -0.28350 -1.0 2.0
   64    69    72    73   0.43600  1.0 3.0
   65    64    68    50   0.37050  1.0 3.0
   65    64    69    70   0.15000  1.0 3.0
   65    64    69    71   0.15000  1.0 3.0
   65    64    69    72   0.23400  1.0 3.0
   68    50    54    55   0.23400  1.0 3.0
   68    50   -54    56   0.62750  1.0 1.0
   68    50   -54    56  -0.30950 -1.0 2.0
   68    50   -54    56   0.27300  1.0 3.0
   68    50    54    58   1.51850  1.0 1.0
   68    64    69    70   0.23400  1.0 3.0
   68    64    69    71   0.23400  1.0 3.0
   68    64    69    72   1.51850  1.0 1.0
   69    64    68    50   0.06250  1.0 1.0
   69    64    68    50  -0.01100 -1.0 2.0
   69    64    68    50   0.28050  1.0 3.0
   70    69    72    73   0.19450  1.0 3.0
   71    69    72    73   0.19450  1.0 3.0
   66    60    64    65   0.23400  1.0 3.0
   66    60    64    68   1.51850  1.0 1.0
   66    60    64    69  -0.47750  1.0 1.0
   62    56    60    61   0.23400  1.0 3.0
   62    56    60    64  -0.47750  1.0 1.0
   62    56    60    66   3.77950  1.0 1.0
   58    54    56    57   0.23400  1.0 3.0
   58    54    56    60  -0.47750  1.0 1.0
   58    54    56    62   3.77950  1.0 1.0
   42    39    40    41   7.00000 -1.0 2.0
   42    39    40    44   7.00000 -1.0 2.0
   42    45    52    53  -0.11600  1.0 1.0
   42    45    52    53  -0.09450 -1.0 2.0
   42    45    52    53   0.21250  1.0 3.0
   43    42    45    46   0.15000  1.0 3.0
   43    42    45    47   0.15000  1.0 3.0
   43    42    45    52   0.23400  1.0 3.0
   43    42    48    49   0.19450  1.0 3.0
   45    42    48    49  -0.11600  1.0 1.0
   45    42    48    49  -0.09450 -1.0 2.0
   45    42    48    49   0.21250  1.0 3.0
   46    45    52    53   0.19450  1.0 3.0
   47    45    52    53   0.19450  1.0 3.0
   48    42    45    46   0.23400  1.0 3.0
   48    42    45    47   0.23400  1.0 3.0
   48    42    45    52   3.75450  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
   38    30    36    37  10.50000 -1.0 2.0
   33    42    39    40  15.00000 -1.0 2.0
   41    44    40    39  15.00000 -1.0 2.0
END
