* LIGAND DATABASE FILE (OPLS2005)
*
001      70    71    127    202     379
    1     0 S   NP   _N1_     1    28.14918    96.80358   -22.20874
    2     1 S   H    _HN1     2     1.02957    74.48717    -6.30335
    3     1 S   H    _H1_     3     1.02836    37.55623   143.08815
    4     1 S   H    _H2_     4     1.02777   101.43229  -112.37496
    5     1 S   CT   _CA1     5     1.50144   141.32251    97.11429
    6     5 S   HC   _HA1     6     1.09577   105.19547    87.17608
    7     5 S   CO3  _C1_     7     1.53765   112.28859   -32.97415
    8     7 S   O2Z  _O11     8     1.26365   114.98828   -45.16269
    9     7 S   O2Z  _O12     9     1.26226   114.91813   133.77563
   10     5 S   CT   _CB1    10     1.53080   107.40197  -154.96521
   11    10 S   HC   HB11    11     1.09832   109.28402   -50.47056
   12    10 S   HC   HB12    12     1.09814   110.45935    66.06313
   13    10 S   CT   _CG1    13     1.53039   112.70521  -171.51990
   14    13 S   HC   HG11    14     1.09592   110.54223   -65.36872
   15    13 S   HC   HG12    15     1.09660   109.88414    53.85396
   16    13 S   C    _CD1    16     1.51854   112.19956   174.19097
   17    16 S   O    _OE1    17     1.22770   123.24683     2.93038
   18    16 S   N    _N2_    18     1.38525   111.81394  -177.06408
   19    18 S   H    _HN2    19     1.01587   119.16576     3.64851
   20    18 S   CT1  _CA2    20     1.45892   122.81919   177.48122
   21    20 S   HC   _HA2    21     1.09723   108.88008    26.04708
   22    20 S   C    _C2_    22     1.52881   106.70831   -91.10436
   23    22 S   O    _O2_    23     1.22994   122.95134   -30.90377
   24    20 S   CT   _CB2    32     1.53198   112.18485   149.32755
   25    24 S   HC   HB21    33     1.09415   109.50249    53.73954
   26    24 S   HC   HB22    34     1.09466   109.90833   172.61762
   27    22 S   N    _N3_    24     1.38483   112.67360   151.45578
   28    27 S   H    _HN3    25     1.01650   120.37321    -0.42796
   29    24 S   S    _SG2    35     1.82883   110.53865   -67.37303
   30    27 S   CT   _CA3    26     1.45364   122.41889   178.88741
   31    30 S   HC   HA31    27     1.09559   107.39396   -66.67816
   32    30 S   HC   HA32    28     1.09574   108.04672    49.66277
   33    29 S   CT   _C11    36     1.84959   101.61695   172.04362
   34    33 S   HC   _H4_    37     1.09455   106.52932   176.83510
   35    30 S   CO3  _C3_    29     1.52882   114.41583   171.84457
   36    35 S   O2Z  _O31    30     1.26323   116.10777     2.04181
   37    35 S   O2Z  _O32    31     1.26459   114.38623  -177.86613
   38    33 S   CM   _C6_    38     1.50493   110.65354    60.87084
   39    38 S   CM   _C7_    39     1.34306   122.04662  -111.05444
   40    39 S   CO4  _C8_    40     1.49294   120.10968     0.20271
   41    40 S   O    _O33    41     1.23372   118.77831   166.54416
   42    39 S   NE   _N5_    56     1.37760   123.16863   179.66023
   43    42 S   H    _H13    57     1.01689   116.70593   177.46549
   44    40 S   CMA  _C9_    42     1.52230   119.43546   -15.27710
   45    44 S   OM   _O36    43     1.26556   113.87728  -165.77966
   46    42 S   CT1  _C15    58     1.45236   123.51093    11.42503
   47    46 S   HC   _H6_    59     1.09647   108.79554    84.35615
   48    33 S   CM   _C10    44     1.51798   110.36831   -66.85603
   49    46 S   CT   _C4_    60     1.53248   108.86585   -35.06537
   50    49 S   HC   _H7_    61     1.09962   108.98338   -72.32119
   51    49 S   HC   _H8_    62     1.09753   109.73814   171.85710
   52    46 S   CO3  _C16    68     1.54067   107.92844  -160.43036
   53    52 S   O2Z  _O38    69     1.26367   116.35610   131.11835
   54    52 S   O2Z  _O37    70     1.26712   114.99803   -50.30932
   55    48 S   CT   _C12    45     1.53676   115.54213   -69.85638
   56    55 S   HC   _H9_    46     1.09592   110.48626    31.64751
   57    55 S   HC   _H10    47     1.09936   108.27805   144.75727
   58    38 S   CT   _C5_    63     1.52390   118.51836    68.63380
   59    58 S   HC   _H3_    64     1.09765   108.99969   -46.54009
   60    55 S   CT1  _C13    48     1.53677   113.10937   -93.40028
   61    60 S   HC   _H5_    49     1.09705   110.09165   -39.82422
   62    58 S   CO3  _C17    65     1.53790   110.27026    71.46538
   63    62 S   O2Z  _O40    66     1.26274   116.65257    58.33637
   64    62 S   O2Z  _O39    67     1.26605   114.40476  -122.28539
   65    60 S   CO3  _C14    50     1.54589   116.22832    84.17838
   66    65 S   O2Z  _O35    51     1.26285   116.63729    26.43587
   67    65 S   O2Z  _O34    52     1.26709   114.32074  -154.55735
   68    60 S   NT   _N4_    53     1.47472   109.30087  -158.12279
   69    68 S   H    _H11    54     1.02021   108.77719   175.19588
   70    68 S   H    _H12    55     1.01939   108.97183    60.00192
  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   8   5   4   3
  16   6   2   1   1  17  14   9   4  11   4   6   2  10   7   8
  10   5   4   3   1   1  10   5   4   4   3   7   6   2   1   1
   5   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    48    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    44    48    55    58  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    44    45    48    55    56    57    60    42    49    58    59    62  
   38    39    44    48    55    58  
   36    37  
   37  
    0  
   39    40    41    44    48    55    42    43    46    49    50    51    58    59    62    63    64  
   40    41    44    45    48    42    43    46    47    49    58    59    62    52  
   41    44    45    48    55    42    43    46    58  
   44    45    48    42  
   43    46    47    49    50    51    58    52    53    54    44  
   46    47    49    52  
   45    48    55    56    57    60  
   48    55  
   47    49    50    51    58    59    62    52    53    54  
   49    50    51    58    52    53    54  
   55    56    57    60    61    65    68    58  
   50    51    58    59    62    63    64    52    53    54  
   51    58    59    62    52  
   58    59    62    52  
   53    54    58  
   54  
    0  
   56    57    60    61    65    66    67    68    69    70  
   57    60    61    65    68  
   60    61    65    68  
   59    62    63    64  
   62    63    64  
   61    65    66    67    68    69    70  
   65    66    67    68    69    70  
   63    64  
   64  
    0  
   66    67    68    69    70  
   67    68  
   68  
   69    70  
   70  
    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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.018000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.2500   0.1700  -0.494200   1.8650   1.6500   0.051222218  -2.220205820
   43   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   45   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   46   3.5000   0.0660  -0.037500   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   48   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   3.5000   0.0660   0.063900   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   64   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   65   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   66   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   67   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   68   3.3000   0.1700  -0.943900   1.8650   1.6500   0.051222218  -2.220205820
   69   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   70   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    48   317.000  1.510
   38    39   549.000  1.340
   38    58   317.000  1.510
   39    40   320.000  1.462
   39    42   425.000  1.378
   40    41   570.000  1.229
   40    44   270.000  1.476
   44    45   745.000  1.250
   44    48   465.000  1.376
   48    55   317.000  1.510
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    60   268.000  1.529
   60    61   340.000  1.090
   60    65   317.000  1.522
   60    68   305.000  1.457
   65    66   656.000  1.250
   65    67   656.000  1.250
   68    69   434.000  1.010
   68    70   434.000  1.010
   42    43   434.000  1.010
   42    46   382.000  1.448
   46    47   340.000  1.090
   46    49   268.000  1.529
   46    52   317.000  1.522
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    58   268.000  1.529
   58    59   340.000  1.090
   58    62   317.000  1.522
   62    63   656.000  1.250
   62    64   656.000  1.250
   52    53   656.000  1.250
   52    54   656.000  1.250
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  112.20000
   29    33    48    75.00000  112.20000
   33    38    39    70.00000  124.00000
   33    38    58    65.00000  117.92700
   33    48    44    70.00000  124.00000
   33    48    55    65.00000  117.92700
   38    33    34    35.00000  109.50000
   38    39    40    65.00000  118.96000
   38    39    42    70.00000  124.03900
   38    58    49    70.00000  112.02700
   38    58    59    35.00000  109.50000
   38    58    62    65.00000  111.94000
   39    40    41    80.00000  123.72100
   39    40    44    65.00000  118.65900
   39    42    43    35.00000  114.50000
   39    42    46    50.00000  121.00000
   40    44    45    85.00000  116.28000
   40    44    48    65.00000  114.61000
   44    40    41    80.00000  120.81000
   44    48    55    70.00000  124.00000
   48    33    34    35.00000  109.50000
   48    33    38    70.00000  110.12100
   48    44    45    65.00000  137.10300
   48    55    56    35.00000  109.50000
   48    55    57    35.00000  109.50000
   48    55    60    70.00000  112.02700
   55    60    61    37.50000  110.70000
   55    60    65    63.00000  111.10000
   55    60    68    80.00000  111.22000
   57    55    56    33.00000  107.80000
   60    55    56    37.50000  110.70000
   60    55    57    37.50000  110.70000
   60    65    66    70.00000  117.00000
   60    65    67    70.00000  117.00000
   60    68    69    50.00000  111.55300
   60    68    70    50.00000  111.55300
   65    60    61    35.00000  109.50000
   67    65    66    80.00000  126.00000
   68    60    61    50.00000  109.55000
   68    60    65    75.00000  111.54000
   70    68    69    43.60000  106.40000
   42    39    40    70.00000  117.92000
   42    46    47    35.00000  109.50000
   42    46    49    80.00000  111.61500
   42    46    52    63.00000  110.10000
   46    42    43    35.00000  112.50000
   46    49    50    37.50000  110.70000
   46    49    51    37.50000  110.70000
   46    49    58    58.35000  112.70000
   46    52    53    70.00000  117.00000
   46    52    54    70.00000  117.00000
   49    46    47    37.50000  110.70000
   49    58    59    37.50000  110.70000
   49    58    62    70.00000  109.69300
   51    49    50    33.00000  107.80000
   58    38    39    70.00000  124.00000
   58    49    50    37.50000  110.70000
   58    49    51    37.50000  110.70000
   58    62    63    70.00000  117.00000
   58    62    64    70.00000  117.00000
   62    58    59    35.00000  109.50000
   64    62    63    80.00000  126.00000
   52    46    47    35.00000  109.50000
   52    46    49    63.00000  111.10000
   54    52    53    80.00000  126.00000
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    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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    48  -0.62250  1.0 1.0
   24    29    33    48  -0.38450 -1.0 2.0
   24    29    33    48   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    38    39   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    58   0.30250  1.0 1.0
   29    33    38    58  -0.14950 -1.0 2.0
   29    33    38    58   0.36900  1.0 3.0
   29    33    48    44   0.42700  1.0 1.0
   29    33    48    44  -0.70350 -1.0 2.0
   29    33    48    44  -0.43150  1.0 3.0
   29    33    48    55   0.30250  1.0 1.0
   29    33    48    55  -0.14950 -1.0 2.0
   29    33    48    55   0.36900  1.0 3.0
   33    38    39    40   7.00000 -1.0 2.0
   33    38    39    42   7.00000 -1.0 2.0
   33    38    58    49   0.46850  1.0 1.0
   33    38    58    49   0.08550 -1.0 2.0
   33    38    58    49   0.09800  1.0 3.0
   33    38    58    59   0.34800  1.0 3.0
   33    38    58    62   0.17250  1.0 1.0
   33    38    58    62  -0.04100 -1.0 2.0
   33    38    58    62  -0.33850  1.0 3.0
   33    48    55    56   0.34800  1.0 3.0
   33    48    55    57   0.34800  1.0 3.0
   33    48    55    60   0.46850  1.0 1.0
   33    48    55    60   0.08550 -1.0 2.0
   33    48    55    60   0.09800  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    58   0.34800  1.0 3.0
   34    33    48    44   0.00000  1.0 1.0
   34    33    48    55   0.34800  1.0 3.0
   38    33    48    44  -0.28300  1.0 1.0
   38    33    48    44   0.26700 -1.0 2.0
   38    33    48    44  -0.63300  1.0 3.0
   38    33    48    55   0.09700  1.0 1.0
   38    33    48    55   0.15600 -1.0 2.0
   38    33    48    55  -0.50800  1.0 3.0
   38    39    40    41   1.00000 -1.0 2.0
   38    39   -40    44  -1.18350  1.0 1.0
   38    39   -40    44   1.45950 -1.0 2.0
   38    39    42    43   1.00000 -1.0 2.0
   38    39    42    46  -0.54700  1.0 1.0
   38    39    42    46   1.23000 -1.0 2.0
   38    58    62    63   0.30150 -1.0 2.0
   38    58    62    64   0.30150 -1.0 2.0
   39    38    58    49   0.09850  1.0 1.0
   39    38    58    49   0.15250 -1.0 2.0
   39    38    58    49  -0.50650  1.0 3.0
   39    38    58    59   0.00000  1.0 1.0
   39    38    58    62  -0.51250  1.0 1.0
   39    38    58    62  -0.88800 -1.0 2.0
   39    38    58    62   0.08850  1.0 3.0
   39    40    44    45   1.50000 -1.0 2.0
   39    40    44    48  -1.18350  1.0 1.0
   39    40    44    48   1.45950 -1.0 2.0
   39    42    46    47   0.00000  1.0 1.0
   39    42   -46    49   0.25450  1.0 1.0
   39    42   -46    49  -0.61700 -1.0 2.0
   39    42   -46    49  -0.23550  1.0 3.0
   39    42    46    52  -0.12500  1.0 1.0
   39    42    46    52  -0.12500 -1.0 2.0
   39    42    46    52   0.25000  1.0 3.0
   40    39    42    43   1.00000 -1.0 2.0
   40    39    42    46   1.00000 -1.0 2.0
   40    44   -48    33   7.00000 -1.0 2.0
   40    44    48    55   7.00000 -1.0 2.0
   41    40    44    45  -0.11900  1.0 1.0
   41    40    44    45   0.76850 -1.0 2.0
   41    40    44    45   0.14100  1.0 3.0
   41    40    44    48   1.00000 -1.0 2.0
   44    48    55    56   0.00000  1.0 1.0
   44    48    55    57   0.00000  1.0 1.0
   44    48    55    60   0.09850  1.0 1.0
   44    48    55    60   0.15250 -1.0 2.0
   44    48    55    60  -0.50650  1.0 3.0
   45    44    48    33   7.00000 -1.0 2.0
   45    44    48    55   7.00000 -1.0 2.0
   48    33   -38    39  -0.28300  1.0 1.0
   48    33   -38    39   0.26700 -1.0 2.0
   48    33   -38    39  -0.63300  1.0 3.0
   48    33    38    58   0.09700  1.0 1.0
   48    33    38    58   0.15600 -1.0 2.0
   48    33    38    58  -0.50800  1.0 3.0
   48    55    60    61   0.15000  1.0 3.0
   48    55    60    65  -0.98800  1.0 1.0
   48    55    60    65   0.48800 -1.0 2.0
   48    55    60    65   0.76800  1.0 3.0
   48    55    60    68   0.59950  1.0 1.0
   48    55    60    68  -0.21400 -1.0 2.0
   48    55    60    68   0.56200  1.0 3.0
   55    60    65    66   0.00000  1.0 1.0
   55    60    65    67   0.00000  1.0 1.0
   55    60    68    69  -0.05950  1.0 1.0
   55    60    68    69   0.08850 -1.0 2.0
   55    60    68    69   0.11750  1.0 3.0
   55    60    68    70  -0.05950  1.0 1.0
   55    60    68    70   0.08850 -1.0 2.0
   55    60    68    70   0.11750  1.0 3.0
   56    55    60    61   0.15000  1.0 3.0
   56    55    60    65  -0.03800  1.0 3.0
   56    55    60    68   0.15000  1.0 3.0
   57    55    60    61   0.15000  1.0 3.0
   57    55    60    65  -0.03800  1.0 3.0
   57    55    60    68   0.15000  1.0 3.0
   61    60    65    66   0.00000  1.0 1.0
   61    60    65    67   0.00000  1.0 1.0
   61    60    68    69   0.20000  1.0 3.0
   61    60    68    70   0.20000  1.0 3.0
   65    60    68    69   0.21900  1.0 1.0
   65    60    68    69  -0.24900 -1.0 2.0
   65    60    68    69   0.15200  1.0 3.0
   65    60    68    70   0.21900  1.0 1.0
   65    60    68    70  -0.24900 -1.0 2.0
   65    60    68    70   0.15200  1.0 3.0
   68    60    65    66   0.30150 -1.0 2.0
   68    60    65    67   0.30150 -1.0 2.0
   42    39    40    41  -0.52200  1.0 1.0
   42    39    40    41   0.82950 -1.0 2.0
   42    39    40    44   1.50000 -1.0 2.0
   42    46    49    50   0.22950  1.0 3.0
   42    46    49    51   0.22950  1.0 3.0
   42    46    49    58   1.26750  1.0 1.0
   42    46    49    58  -0.00950 -1.0 2.0
   42    46    49    58   0.30600  1.0 3.0
   42    46    52    53   0.00000  1.0 1.0
   42    46    52    54   0.00000  1.0 1.0
   43    42    46    47   0.00000  1.0 1.0
   43    42    46    49   0.00000  1.0 1.0
   43    42    46    52   0.00000  1.0 1.0
   46    49   -58    38   0.34400  1.0 1.0
   46    49   -58    38   0.09450 -1.0 2.0
   46    49   -58    38   0.11100  1.0 3.0
   46    49    58    59   0.15000  1.0 3.0
   46    49    58    62  -0.84850  1.0 1.0
   46    49    58    62  -0.22800 -1.0 2.0
   46    49    58    62   0.29250  1.0 3.0
   47    46    49    50   0.15000  1.0 3.0
   47    46    49    51   0.15000  1.0 3.0
   47    46    49    58   0.15000  1.0 3.0
   47    46    52    53   0.00000  1.0 1.0
   47    46    52    54   0.00000  1.0 1.0
   49    46    52    53   0.00000  1.0 1.0
   49    46    52    54   0.00000  1.0 1.0
   49    58    62    63   0.41150 -1.0 2.0
   49    58    62    64   0.41150 -1.0 2.0
   50    49    58    38   0.15000  1.0 3.0
   50    49    58    59   0.15000  1.0 3.0
   50    49    58    62  -0.11250  1.0 3.0
   51    49    58    38   0.15000  1.0 3.0
   51    49    58    59   0.15000  1.0 3.0
   51    49    58    62  -0.11250  1.0 3.0
   58    38    39    40   7.00000 -1.0 2.0
   58    38   -39    42   7.00000 -1.0 2.0
   59    58    62    63   0.00000  1.0 1.0
   59    58    62    64   0.00000  1.0 1.0
   52    46    49    50  -0.03800  1.0 3.0
   52    46    49    51  -0.03800  1.0 3.0
   52    46    49    58  -0.84850  1.0 1.0
   52    46    49    58  -0.22800 -1.0 2.0
   52    46    49    58   0.29250  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
   33    58    38    39   1.10000 -1.0 2.0
   40    42    39    38   1.10000 -1.0 2.0
   39    44    40    41  10.50000 -1.0 2.0
   40    45    44    48   1.10000 -1.0 2.0
   33    55    48    44   1.10000 -1.0 2.0
   66    60    65    67  10.50000 -1.0 2.0
   43    39    42    46   1.00000 -1.0 2.0
   63    58    62    64  10.50000 -1.0 2.0
   53    46    52    54  10.50000 -1.0 2.0
END
