* LIGAND DATABASE FILE (OPLS2005)
*
001      71    74    129    214     382
    1     0 S   NP   _N1_     1    28.77784    95.83672   -21.09329
    2     1 S   H    _HN1     2     1.02780    90.15019   -97.68691
    3     1 S   H    _H1_     3     1.02950    79.07829    11.01167
    4     1 S   H    _H2_     4     1.02824    40.53264   144.25641
    5     1 S   CT   _CA1     5     1.50119   149.89944   122.97925
    6     5 S   HC   _HA1     6     1.09569   105.19516    73.80640
    7     5 S   CO3  _C1_     7     1.53841   112.49525   -46.40051
    8     7 S   O2Z  _O11     8     1.26376   114.97190   -40.13610
    9     7 S   O2Z  _O12     9     1.26251   115.00822   138.92957
   10     5 S   CT   _CB1    10     1.53086   107.40252  -168.14662
   11    10 S   HC   HB11    11     1.09822   109.50803   -48.94084
   12    10 S   HC   HB12    12     1.09814   110.39472    67.75945
   13    10 S   CT   _CG1    13     1.52896   112.49343  -169.91790
   14    13 S   HC   HG11    14     1.09587   110.43491   -63.85215
   15    13 S   HC   HG12    15     1.09662   109.91525    55.31046
   16    13 S   C    _CD1    16     1.51783   112.46715   175.88225
   17    16 S   O    _OE1    17     1.22698   123.45117     2.14430
   18    16 S   N    _N2_    18     1.38535   111.38891  -178.08899
   19    18 S   H    _HN2    19     1.01630   118.78260     1.17203
   20    18 S   CT1  _CA2    20     1.46151   123.88140  -177.80411
   21    20 S   HC   _HA2    21     1.09725   109.29646     3.76187
   22    20 S   C    _C2_    22     1.53423   109.12582  -112.23023
   23    22 S   O    _O2_    23     1.23076   122.16175  -149.42360
   24    20 S   CT   _CB2    32     1.53506   110.95227   125.48476
   25    24 S   HC   HB21    33     1.09177   109.57684    60.94210
   26    24 S   HC   HB22    34     1.09542   110.40676   178.58155
   27    22 S   N    _N3_    24     1.38292   113.82624    38.04968
   28    27 S   H    _HN3    25     1.01592   119.55928    -3.59292
   29    24 S   S    _SG2    35     1.82849   110.87602   -62.76169
   30    27 S   CT   _CA3    26     1.45291   123.15432   177.01109
   31    30 S   HC   HA31    27     1.09550   107.50821   -64.20975
   32    30 S   HC   HA32    28     1.09557   107.96696    52.20078
   33    29 S   CT   _C20    36     1.86953   102.91202   138.14143
   34    30 S   CO3  _C3_    29     1.52942   114.14519   174.18308
   35    34 S   O2Z  _O31    30     1.26367   116.07725    -1.22589
   36    34 S   O2Z  _O32    31     1.26437   114.40726   178.84529
   37    33 S   CM   _C16    37     1.53210   106.09016   167.32803
   38    33 S   CO4  _C18    68     1.51631   109.54910    48.59323
   39    38 S   O    _O21    69     1.22797   123.29313   -99.31521
   40    37 S   CA   _C11    38     1.48887   104.95380    90.53945
   41    37 S   CMA  _C17    57     1.36153   126.47075   -96.80188
   42    41 S   OM   _O20    58     1.26702   127.93640  -170.80324
   43    40 S   CA   _C12    39     1.40455   108.20954    20.15226
   44    41 S   CA   _C9_    59     1.51931   113.19303     7.80799
   45    43 S   CA   _C7_    40     1.39388   121.57013   178.70457
   46    45 S   HA   _H28    41     1.08596   120.59089  -177.81269
   47    33 S   CT   _C19    52     1.56116   116.46282   -79.24130
   48    47 S   HC   _H30    53     1.09966   109.70706   163.30585
   49    44 S   CA   _C5_    60     1.41270   120.33362   159.40142
   50    49 S   HA   _H26    61     1.08858   120.73562    -2.88419
   51    45 S   CA   _C13    42     1.39807   119.28517     2.61232
   52    47 S   NT   _N19    54     1.45964   116.20838    41.06072
   53    52 S   H    _H34    55     1.01945   109.51966   179.62780
   54    52 S   H    _H35    56     1.01984   108.67779    64.97891
   55    49 S   CA   _C4_    62     1.39789   121.76415   177.07069
   56    55 S   HA   _H25    63     1.08625   119.84207  -179.95577
   57    51 S   CA   _C8_    43     1.40418   119.37112     0.14804
   58    57 S   HA   _H29    44     1.08784   119.17041   178.46481
   59    51 S   CT   _C21    48     1.49965   120.87385  -179.60883
   60    59 S   HC   _H31    49     1.09463   110.00739   113.05290
   61    59 S   HC   _H32    50     1.09470   110.29177  -126.49103
   62    59 S   HC   _H33    51     1.09469   111.57169    -6.80377
   63    55 S   CA   _C6_    64     1.38906   120.06921    -0.26393
   64    63 S   HA   _H27    65     1.08624   119.88020  -179.78878
   65    40 S   CA   _C15    45     1.39103   132.77010  -155.71624
   66    63 S   CA   _C14    66     1.39109   119.53485     0.53008
   67    65 S   OH   _O23    46     1.36443   121.04915     2.28156
   68    67 S   HO   _H37    47     0.97099   109.25691  -178.33082
   69    44 S   CA   _C10    67     1.40555   122.63164   -23.02290
   70    66 S   OH   _O22    70     1.36892   116.26278   179.19158
   71    70 S   HO   _H36    71     0.97359   108.81858   175.08945
  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  11   5   4   3
  17   2   1   1  16  13   4  15  10   3  12   8  12   4   7   3
   7   4   8   2   1   1   6   3   8   3   4   2   1   1   5   3
   2   3   1   1   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    47    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    43    47    48    52    41    69    38    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    43    45    65    47    48    52    53    54    41    42    44    66    69    38    39  
   35    36  
   36  
    0  
   40    43    45    57    65    67    47    48    52    41    42    44    49    69    38    39  
   39    70    40    41    43    44    47    48    49    52    63    66    69  
   44    47    66    69  
   43    45    46    51    57    58    65    67    68    47    48    52    41    42    44  
   42    44    49    50    55    66    69    43    47    65  
   44    49    69  
   45    46    51    57    65    67    59    47    48    52    53    54  
   49    50    55    56    63    66    69    70  
   46    51    57    58    65    59    60    61    62    47    48    52  
   51    57    59    47  
   48    52    53    54    69    51    65  
   52    53    54  
   50    55    56    63    64    66    69  
   55    56    63    69  
   57    58    65    67    59    60    61    62  
   53    54  
   54  
    0  
   56    63    64    66    69    70  
   63    64    66  
   58    65    67    68    59    60    61    62  
   65    67    59  
   60    61    62    65  
   61    62  
   62  
    0  
   64    66    69    70    71  
   66    69    70  
   67    68  
   69    70    71  
   68  
    0  
   70    71  
   71  
    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  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5000   0.0660   0.235000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   52   3.3000   0.1700  -0.900000   1.8650   1.6500   0.051222218  -2.220205820
   53   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   54   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   66   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   67   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   69   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   70   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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    47   268.000  1.529
   33    38   317.000  1.522
   37    40   320.000  1.460
   37    41   465.000  1.376
   40    43   469.000  1.400
   40    65   469.000  1.400
   43    45   469.000  1.400
   43    47   317.000  1.510
   45    46   367.000  1.080
   45    51   469.000  1.400
   51    57   469.000  1.400
   51    59   317.000  1.510
   57    58   367.000  1.080
   57    65   469.000  1.400
   65    67   450.000  1.364
   67    68   553.000  0.945
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   47    48   340.000  1.090
   47    52   382.000  1.448
   52    53   434.000  1.010
   52    54   434.000  1.010
   41    42   745.000  1.250
   41    44   320.000  1.460
   44    49   469.000  1.400
   44    69   469.000  1.400
   49    50   367.000  1.080
   49    55   469.000  1.400
   55    56   367.000  1.080
   55    63   469.000  1.400
   63    64   367.000  1.080
   63    66   469.000  1.400
   66    69   469.000  1.400
   66    70   450.000  1.364
   69    38   310.000  1.470
   38    39   570.000  1.229
   70    71   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    47    75.00000  111.63000
   29    33    38    75.00000  110.18000
   33    37    40    65.00000  118.87000
   33    37    41    70.00000  124.00000
   33    47    43    70.00000  112.17500
   33    47    48    37.50000  110.70000
   33    47    52    56.20000  109.47000
   33    38    69    65.00000  115.47100
   33    38    39    80.00000  120.40000
   37    40    43    60.00000  120.93500
   37    40    65    60.00000  120.93500
   37    41    42    65.00000  137.10300
   37    41    44    60.00000  123.20500
   40    43    45    63.00000  120.00000
   40    43    47    70.00000  120.00000
   40    65    57    63.00000  120.00000
   40    65    67    70.00000  120.00000
   43    45    46    35.00000  120.00000
   43    45    51    63.00000  120.00000
   43    47    48    35.00000  109.50000
   43    47    52    75.00000  112.33000
   45    51    57    63.00000  120.00000
   45    51    59    70.00000  120.00000
   51    45    46    35.00000  120.00000
   51    57    58    35.00000  120.00000
   51    57    65    63.00000  120.00000
   51    59    60    35.00000  109.50000
   51    59    61    35.00000  109.50000
   51    59    62    35.00000  109.50000
   57    65    67    70.00000  120.00000
   65    40    43    63.00000  120.00000
   65    57    58    35.00000  120.00000
   65    67    68    35.00000  113.00000
   59    51    57    70.00000  120.00000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   47    33    37    70.00000  112.02700
   47    43    45    70.00000  120.00000
   47    52    53    35.00000  109.50000
   47    52    54    35.00000  109.50000
   52    47    48    35.00000  109.50000
   54    52    53    43.60000  106.40000
   41    37    40    60.00000  123.20500
   41    44    49    60.00000  120.93500
   41    44    69    60.00000  120.93500
   44    41    42    85.00000  114.86500
   44    49    50    35.00000  120.00000
   44    49    55    63.00000  120.00000
   44    69    66    63.00000  120.00000
   44    69    38    60.00000  119.52600
   49    55    56    35.00000  120.00000
   49    55    63    63.00000  120.00000
   55    49    50    35.00000  120.00000
   55    63    64    35.00000  120.00000
   55    63    66    63.00000  120.00000
   63    55    56    35.00000  120.00000
   63    66    69    63.00000  120.00000
   63    66    70    70.00000  120.00000
   66    63    64    35.00000  120.00000
   66    69    38    60.00000  119.52600
   66    70    71    35.00000  113.00000
   69    44    49    63.00000  120.00000
   69    38    39    75.00000  123.78400
   38    33    37    70.00000  109.06800
   38    33    47    63.00000  111.10000
   70    66    69    70.00000  120.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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    47   0.01700  1.0 1.0
   24    29    33    47  -0.23550 -1.0 2.0
   24    29    33    47   0.21350  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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    40   0.09700  1.0 1.0
   29    33    37    40   0.15600 -1.0 2.0
   29    33    37    40  -0.50800  1.0 3.0
   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    47    43   0.56750  1.0 1.0
   29    33    47    43  -0.07550 -1.0 2.0
   29    33    47    43   0.20000  1.0 3.0
   29    33    47    48   0.15000  1.0 3.0
   29    33    47    52   0.56750  1.0 1.0
   29    33    47    52  -0.07550 -1.0 2.0
   29    33    47    52   0.20000  1.0 3.0
   29    33    38    69   0.65300  1.0 1.0
   29    33    38    69  -0.03850 -1.0 2.0
   29    33    38    69   0.33900  1.0 3.0
   29    33    38    39   0.30150 -1.0 2.0
   33    37   -40    43  -0.02500  1.0 1.0
   33    37   -40    43  -0.32150 -1.0 2.0
   33    37   -40    43  -0.01500  1.0 3.0
   33    37    40    65  -0.02500  1.0 1.0
   33    37    40    65  -0.32150 -1.0 2.0
   33    37    40    65  -0.01500  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    44   7.00000 -1.0 2.0
   33    47    52    53  -0.05950  1.0 1.0
   33    47    52    53   0.08850 -1.0 2.0
   33    47    52    53   0.11750  1.0 3.0
   33    47    52    54  -0.05950  1.0 1.0
   33    47    52    54   0.08850 -1.0 2.0
   33    47    52    54   0.11750  1.0 3.0
   37    33   -47    43   0.21200  1.0 1.0
   37    33   -47    43   0.16900 -1.0 2.0
   37    33   -47    43  -1.15100  1.0 3.0
   37    33    47    48   0.15000  1.0 3.0
   37    33    47    52   0.59950  1.0 1.0
   37    33    47    52  -0.21400 -1.0 2.0
   37    33    47    52   0.56200  1.0 3.0
   37    33    38    69   0.65300  1.0 1.0
   37    33    38    69  -0.03850 -1.0 2.0
   37    33    38    69   0.33900  1.0 3.0
   37    33    38    39   0.30150 -1.0 2.0
   37    40    43    45   3.62500 -1.0 2.0
   37    40   -43    47   3.62500 -1.0 2.0
   37    40    65    57   3.62500 -1.0 2.0
   37    40    65    67   3.62500 -1.0 2.0
   37    41    44    49   0.15800  1.0 1.0
   37    41    44    49   1.85350 -1.0 2.0
   37    41    44    49  -0.48700  1.0 3.0
   37    41   -44    69   0.15800  1.0 1.0
   37    41   -44    69   1.85350 -1.0 2.0
   37    41   -44    69  -0.48700  1.0 3.0
   40    37    41    42   7.00000 -1.0 2.0
   40    37    41    44   7.00000 -1.0 2.0
   40    43    45    46   3.62500 -1.0 2.0
   40    43    45    51   3.62500 -1.0 2.0
   40    43   -47    33   0.04150 -1.0 2.0
   40    43    47    48   0.00000  1.0 1.0
   40    43    47    52   0.18550 -1.0 2.0
   40    43    47    52   0.14000  1.0 3.0
   40    65    67    68   0.84100 -1.0 2.0
   43    40    65    57   3.62500 -1.0 2.0
   43    40    65    67   3.62500 -1.0 2.0
   43    45   -51    57   3.62500 -1.0 2.0
   43    45    51    59   3.62500 -1.0 2.0
   43    47    52    53   0.76500  1.0 1.0
   43    47    52    53   0.05700 -1.0 2.0
   43    47    52    53  -0.90900  1.0 3.0
   43    47    52    54   0.76500  1.0 1.0
   43    47    52    54   0.05700 -1.0 2.0
   43    47    52    54  -0.90900  1.0 3.0
   45    43    47    33   0.04150 -1.0 2.0
   45    43    47    48   0.00000  1.0 1.0
   45    43    47    52   0.18550 -1.0 2.0
   45    43    47    52   0.14000  1.0 3.0
   45    51    57    58   3.62500 -1.0 2.0
   45    51    57    65   3.62500 -1.0 2.0
   45    51    59    60   0.00000  1.0 1.0
   45    51    59    61   0.00000  1.0 1.0
   45    51    59    62   0.00000  1.0 1.0
   46    45    51    57   3.62500 -1.0 2.0
   46    45    51    59   3.62500 -1.0 2.0
   51    57   -65    40   3.62500 -1.0 2.0
   51    57    65    67   3.62500 -1.0 2.0
   57    51    59    60   0.00000  1.0 1.0
   57    51    59    61   0.00000  1.0 1.0
   57    51    59    62   0.00000  1.0 1.0
   57    65    67    68   0.84100 -1.0 2.0
   58    57    65    40   3.62500 -1.0 2.0
   58    57    65    67   3.62500 -1.0 2.0
   65    40   -43    45   3.62500 -1.0 2.0
   65    40    43    47   3.62500 -1.0 2.0
   59    51    57    58   3.62500 -1.0 2.0
   59    51    57    65   3.62500 -1.0 2.0
   47    33   -37    40  -0.01700  1.0 1.0
   47    33   -37    40   0.06550 -1.0 2.0
   47    33   -37    40  -0.91500  1.0 3.0
   47    33    37    41   0.09850  1.0 1.0
   47    33    37    41   0.15250 -1.0 2.0
   47    33    37    41  -0.50650  1.0 3.0
   47    33    38    69   0.05850 -1.0 2.0
   47    33    38    69   0.17250  1.0 3.0
   47    33    38    39   0.30150 -1.0 2.0
   47    43    45    46   3.62500 -1.0 2.0
   47    43    45    51   3.62500 -1.0 2.0
   48    47    52    53   0.20000  1.0 3.0
   48    47    52    54   0.20000  1.0 3.0
   41    37    40    43   0.15800  1.0 1.0
   41    37    40    43   1.85350 -1.0 2.0
   41    37    40    43  -0.48700  1.0 3.0
   41    37    40    65   0.15800  1.0 1.0
   41    37    40    65   1.85350 -1.0 2.0
   41    37    40    65  -0.48700  1.0 3.0
   41    44    49    50   3.62500 -1.0 2.0
   41    44    49    55   3.62500 -1.0 2.0
   41    44    69    66   3.62500 -1.0 2.0
   41    44    69    38   3.62500 -1.0 2.0
   42    41    44    49  -0.01750  1.0 1.0
   42    41    44    49  -0.32000 -1.0 2.0
   42    41    44    49   0.00600  1.0 3.0
   42    41    44    69  -0.01750  1.0 1.0
   42    41    44    69  -0.32000 -1.0 2.0
   42    41    44    69   0.00600  1.0 3.0
   44    49    55    56   3.62500 -1.0 2.0
   44    49    55    63   3.62500 -1.0 2.0
   44    69   -38    33   2.26350  1.0 1.0
   44    69   -38    33   0.76750 -1.0 2.0
   44    69   -38    33   0.22500  1.0 3.0
   44    69    38    39   1.05000 -1.0 2.0
   49    44    69    66   3.62500 -1.0 2.0
   49    44    69    38   3.62500 -1.0 2.0
   49    55    63    64   3.62500 -1.0 2.0
   49    55   -63    66   3.62500 -1.0 2.0
   50    49    55    56   3.62500 -1.0 2.0
   50    49    55    63   3.62500 -1.0 2.0
   55    63    66    69   3.62500 -1.0 2.0
   55    63    66    70   3.62500 -1.0 2.0
   56    55    63    64   3.62500 -1.0 2.0
   56    55    63    66   3.62500 -1.0 2.0
   63    66   -69    44   3.62500 -1.0 2.0
   63    66    69    38   3.62500 -1.0 2.0
   63    66    70    71   0.84100 -1.0 2.0
   64    63    66    69   3.62500 -1.0 2.0
   64    63    66    70   3.62500 -1.0 2.0
   66    69    38    33   2.26350  1.0 1.0
   66    69    38    33   0.76750 -1.0 2.0
   66    69    38    33   0.22500  1.0 3.0
   66    69    38    39   1.05000 -1.0 2.0
   69    44    49    50   3.62500 -1.0 2.0
   69    44   -49    55   3.62500 -1.0 2.0
   69    66    70    71   0.84100 -1.0 2.0
   38    33    37    40   0.09700  1.0 1.0
   38    33    37    40   0.15600 -1.0 2.0
   38    33    37    40  -0.50800  1.0 3.0
   38    33   -37    41  -0.51250  1.0 1.0
   38    33   -37    41  -0.88800 -1.0 2.0
   38    33   -37    41   0.08850  1.0 3.0
   38    33    47    43   0.56750  1.0 1.0
   38    33    47    43  -0.07550 -1.0 2.0
   38    33    47    43   0.20000  1.0 3.0
   38    33    47    48  -0.11250  1.0 3.0
   38    33    47    52  -3.56550  1.0 1.0
   38    33    47    52  -0.67500 -1.0 2.0
   38    33    47    52   1.11300  1.0 3.0
   70    66    69    44   3.62500 -1.0 2.0
   70    66    69    38   3.62500 -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    40    37    41   1.10000 -1.0 2.0
   43    65    40    37   4.00000 -1.0 2.0
   45    47    43    40   4.00000 -1.0 2.0
   51    46    45    43   1.10000 -1.0 2.0
   57    59    51    45   4.00000 -1.0 2.0
   65    58    57    51   1.10000 -1.0 2.0
   57    67    65    40   4.00000 -1.0 2.0
   44    42    41    37   1.10000 -1.0 2.0
   49    69    44    41   4.00000 -1.0 2.0
   55    50    49    44   1.10000 -1.0 2.0
   63    56    55    49   1.10000 -1.0 2.0
   66    64    63    55   1.10000 -1.0 2.0
   69    70    66    63   4.00000 -1.0 2.0
   66    38    69    44   4.00000 -1.0 2.0
   33    69    38    39  10.50000 -1.0 2.0
END
