* LIGAND DATABASE FILE (OPLS2005)
*
001      71    71    131    192     382
    1     0 S   NP   _N1_     1    28.69898    96.05071   -24.04302
    2     1 S   H    _HN1     2     1.02785   108.58578   -89.39345
    3     1 S   H    _H1_     3     1.02950    73.55485    14.92652
    4     1 S   H    _H2_     4     1.02828    35.39106   175.65512
    5     1 S   CT   _CA1     5     1.50112   134.58354   117.60279
    6     5 S   HC   _HA1     6     1.09572   105.19802    90.92508
    7     5 S   CO3  _C1_     7     1.53793   112.47396   -29.31544
    8     7 S   O2Z  _O11     8     1.26373   115.00624   -42.13528
    9     7 S   O2Z  _O12     9     1.26241   114.95188   137.01657
   10     5 S   CT   _CB1    10     1.53082   107.42408  -151.07633
   11    10 S   HC   HB11    11     1.09831   109.38970   -49.61056
   12    10 S   HC   HB12    12     1.09813   110.43509    67.00345
   13    10 S   CT   _CG1    13     1.52987   112.60368  -170.59063
   14    13 S   HC   HG11    14     1.09582   110.61805   -65.36932
   15    13 S   HC   HG12    15     1.09669   109.79959    53.86259
   16    13 S   C    _CD1    16     1.51798   112.25133   174.32760
   17    16 S   O    _OE1    17     1.22728   123.29858     6.34539
   18    16 S   N    _N2_    18     1.38655   111.65451  -173.78539
   19    18 S   H    _HN2    19     1.01580   118.92717     1.83355
   20    18 S   CT1  _CA2    20     1.46188   123.38544   177.76507
   21    20 S   HC   _HA2    21     1.09736   109.38403     1.92681
   22    20 S   C    _C2_    22     1.53534   108.59048  -113.58409
   23    22 S   O    _O2_    23     1.23059   122.27398  -147.72689
   24    20 S   CT   _CB2    32     1.53349   111.58030   123.96165
   25    24 S   HC   HB21    33     1.09466   109.90101    56.54680
   26    24 S   HC   HB22    34     1.09516   110.05226   175.52105
   27    22 S   N    _N3_    24     1.38325   113.69162    39.68718
   28    27 S   H    _HN3    25     1.01591   119.58315    -3.29604
   29    24 S   S    _SG2    35     1.82791   111.44652   -64.76117
   30    27 S   CT   _CA3    26     1.45289   123.20866   177.13761
   31    30 S   HC   HA31    27     1.09550   107.50836   -64.58120
   32    30 S   HC   HA32    28     1.09558   107.98396    51.85431
   33    29 S   CT   _C13    36     1.84965    99.99566  -176.93714
   34    33 S   HC   _H4_    37     1.09157   103.62204    39.48051
   35    30 S   CO3  _C3_    29     1.52962   114.08430   173.85184
   36    35 S   O2Z  _O31    30     1.26375   116.06446    -0.70388
   37    35 S   O2Z  _O32    31     1.26428   114.41423   179.35623
   38    33 S   CM   _C6_    38     1.54485   109.10026   154.75929
   39    33 S   CT   _C14    63     1.53793   111.76696   -75.01799
   40    39 S   HC   _H19    64     1.09618   111.12885    51.93919
   41    39 S   HC   _H20    65     1.09233   113.83267   -66.75548
   42    38 S   CM   _C5_    39     1.36312   124.19212    68.96959
   43    39 S   CO4  _C15    66     1.51533   112.13453   171.37006
   44    43 S   O    _O34    67     1.23075   121.47845    91.27535
   45    42 S   CT   _C10    40     1.51642   122.93654  -177.51572
   46    45 S   HC   _H10    41     1.09794   110.23994   138.12947
   47    45 S   HC   _H11    42     1.09843   108.64821  -106.75985
   48    42 S   CT   _C4_    59     1.51103   126.37260     1.19124
   49    48 S   HC   _H5_    60     1.09495   109.83026   108.29133
   50    48 S   HC   _H6_    61     1.08806   114.76199   -13.88586
   51    48 S   HC   _H7_    62     1.09606   110.33153  -132.66613
   52    43 S   CT   _C16    68     1.50634   117.13972   -88.92596
   53    52 S   HC   _H21    69     1.09217   110.06333    52.77240
   54    52 S   HC   _H22    70     1.09268   109.42026   -68.23732
   55    52 S   HC   _H23    71     1.09350   109.62647   172.16702
   56    45 S   CT   _C9_    43     1.52004   114.59505    16.92902
   57    56 S   HC   _H3_    44     1.09549   110.85492    75.35972
   58    56 S   CT   _C8_    45     1.51451   109.22145   -46.93420
   59    58 S   HC   _H8_    46     1.09856   109.59166  -175.23618
   60    58 S   HC   _H9_    47     1.10031   108.54118   -61.39563
   61    56 S   OH   _O33    57     1.42465   109.67341  -165.98827
   62    61 S   HO   _H12    58     0.97248   107.48489   -59.76772
   63    38 S   CT   _C7_    48     1.56317   115.11636  -109.79533
   64    63 S   CT   _C11    49     1.54759   113.16555   -50.55042
   65    64 S   HC   _H13    50     1.09718   110.78725  -173.03632
   66    64 S   HC   _H14    51     1.09343   112.97337    68.16049
   67    64 S   HC   _H15    52     1.09501   111.25081   -53.82416
   68    63 S   CT   _C12    53     1.54536   108.98344    69.95808
   69    68 S   HC   _H16    54     1.09625   111.14915   174.31531
   70    68 S   HC   _H17    55     1.09548   111.79304    54.04938
   71    68 S   HC   _H18    56     1.09557   111.76680   -66.42708
  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   9   5   4   3
  15   7   2   1   1  25  10   4   3  14   5   4  14   6   5   5
   2   1   1   3   2   1   1   9   6  13   5   4   2   1   8   7
   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    63    39    40    41    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    45    58    63    64    68    48    39    40    41    43    44    52  
   38    42    63    39    40    41    43  
   36    37  
   37  
    0  
   42    45    46    47    56    58    59    60    63    64    65    66    67    68    69    70    71    48    49    50    51    39    40    41    43  
   40    41    43    44    52    53    54    55    42    63  
   41    43    44    52  
   43    44    52  
   45    46    47    56    57    58    63    64    68    61    48    49    50    51  
   44    52    53    54    55  
   52    53    54    55  
   46    47    56    57    58    59    60    63    61    62    48    49    50    51  
   47    56    57    58    61    48  
   56    57    58    61    48  
   49    50    51    56    63  
   50    51  
   51  
    0  
   53    54    55  
   54    55  
   55  
    0  
   57    58    59    60    63    64    68    61    62  
   58    59    60    63    61    62  
   59    60    63    64    65    66    67    68    69    70    71    61    62  
   60    63    64    68    61  
   63    64    68    61  
   62    63  
    0  
   64    65    66    67    68    69    70    71  
   65    66    67    68    69    70    71  
   66    67    68  
   67    68  
   68  
   69    70    71  
   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   0.107500   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.4200   0.0150   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   64   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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    39   268.000  1.529
   38    42   549.000  1.340
   38    63   317.000  1.510
   42    45   317.000  1.510
   42    48   317.000  1.510
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    56   268.000  1.529
   56    57   340.000  1.090
   56    58   268.000  1.529
   56    61   320.000  1.410
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    63   268.000  1.529
   63    64   268.000  1.529
   63    68   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   61    62   553.000  0.945
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    43   317.000  1.522
   43    44   570.000  1.229
   43    52   317.000  1.522
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    39    75.00000  111.63000
   33    38    42    70.00000  124.00000
   33    38    63    65.00000  117.92700
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    43    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    42    45    70.00000  124.00000
   38    42    48    70.00000  124.00000
   38    63    58    70.00000  112.02700
   38    63    64    70.00000  112.02700
   38    63    68    70.00000  112.02700
   42    45    46    35.00000  109.50000
   42    45    47    35.00000  109.50000
   42    45    56    70.00000  112.02700
   42    48    49    35.00000  109.50000
   42    48    50    35.00000  109.50000
   42    48    51    35.00000  109.50000
   45    56    57    37.50000  110.70000
   45    56    58    58.35000  112.70000
   45    56    61    50.00000  109.50000
   47    45    46    33.00000  107.80000
   56    45    46    37.50000  110.70000
   56    45    47    37.50000  110.70000
   56    58    59    37.50000  110.70000
   56    58    60    37.50000  110.70000
   56    58    63    58.35000  112.70000
   56    61    62    55.00000  108.50000
   58    56    57    37.50000  110.70000
   58    63    64    58.35000  112.70000
   58    63    68    58.35000  112.70000
   60    58    59    33.00000  107.80000
   63    38    42    70.00000  124.00000
   63    58    59    37.50000  110.70000
   63    58    60    37.50000  110.70000
   63    64    65    37.50000  110.70000
   63    64    66    37.50000  110.70000
   63    64    67    37.50000  110.70000
   63    68    69    37.50000  110.70000
   63    68    70    37.50000  110.70000
   63    68    71    37.50000  110.70000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   68    63    64    58.35000  112.70000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   61    56    57    35.00000  109.50000
   61    56    58    50.00000  109.50000
   48    42    45    65.00000  117.92700
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.02700
   39    43    44    80.00000  120.40000
   39    43    52    70.00000  116.00000
   41    39    40    33.00000  107.80000
   43    39    40    35.00000  109.50000
   43    39    41    35.00000  109.50000
   43    52    53    35.00000  109.50000
   43    52    54    35.00000  109.50000
   43    52    55    35.00000  109.50000
   52    43    44    80.00000  120.40000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  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    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    38    63   0.30250  1.0 1.0
   29    33    38    63  -0.14950 -1.0 2.0
   29    33    38    63   0.36900  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   33    38    42    45   7.00000 -1.0 2.0
   33    38    42    48   7.00000 -1.0 2.0
   33    38    63    58   0.46850  1.0 1.0
   33    38    63    58   0.08550 -1.0 2.0
   33    38    63    58   0.09800  1.0 3.0
   33    38    63    64   0.46850  1.0 1.0
   33    38    63    64   0.08550 -1.0 2.0
   33    38    63    64   0.09800  1.0 3.0
   33    38    63    68   0.46850  1.0 1.0
   33    38    63    68   0.08550 -1.0 2.0
   33    38    63    68   0.09800  1.0 3.0
   33    39    43    44   0.30150 -1.0 2.0
   33    39    43    52   0.60050  1.0 1.0
   33    39    43    52   0.05600 -1.0 2.0
   33    39    43    52   0.26150  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    38    63   0.34800  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    43  -0.11250  1.0 3.0
   38    33    39    40   0.15000  1.0 3.0
   38    33    39    41   0.15000  1.0 3.0
   38    33    39    43  -0.98800  1.0 1.0
   38    33    39    43   0.48800 -1.0 2.0
   38    33    39    43   0.76800  1.0 3.0
   38    42    45    46   0.00000  1.0 1.0
   38    42    45    47   0.00000  1.0 1.0
   38    42    45    56   0.09850  1.0 1.0
   38    42    45    56   0.15250 -1.0 2.0
   38    42    45    56  -0.50650  1.0 3.0
   38    42    48    49   0.00000  1.0 1.0
   38    42    48    50   0.00000  1.0 1.0
   38    42    48    51   0.00000  1.0 1.0
   38    63    64    65   0.15000  1.0 3.0
   38    63    64    66   0.15000  1.0 3.0
   38    63    64    67   0.15000  1.0 3.0
   38    63    68    69   0.15000  1.0 3.0
   38    63    68    70   0.15000  1.0 3.0
   38    63    68    71   0.15000  1.0 3.0
   42    38    63    58   0.09850  1.0 1.0
   42    38    63    58   0.15250 -1.0 2.0
   42    38    63    58  -0.50650  1.0 3.0
   42    38    63    64   0.09850  1.0 1.0
   42    38    63    64   0.15250 -1.0 2.0
   42    38    63    64  -0.50650  1.0 3.0
   42    38    63    68   0.09850  1.0 1.0
   42    38    63    68   0.15250 -1.0 2.0
   42    38    63    68  -0.50650  1.0 3.0
   42    45    56    57   0.15000  1.0 3.0
   42    45   -56    58   0.34400  1.0 1.0
   42    45   -56    58   0.09450 -1.0 2.0
   42    45   -56    58   0.11100  1.0 3.0
   42    45    56    61   1.05650  1.0 1.0
   42    45    56    61   0.15600 -1.0 2.0
   42    45    56    61   0.53150  1.0 3.0
   45    42    48    49   0.34800  1.0 3.0
   45    42    48    50   0.34800  1.0 3.0
   45    42    48    51   0.34800  1.0 3.0
   45    56    58    59   0.15000  1.0 3.0
   45    56    58    60   0.15000  1.0 3.0
   45    56    58    63   0.56750  1.0 1.0
   45    56    58    63  -0.07550 -1.0 2.0
   45    56    58    63   0.20000  1.0 3.0
   45    56    61    62  -0.11600  1.0 1.0
   45    56    61    62  -0.09450 -1.0 2.0
   45    56    61    62   0.21250  1.0 3.0
   46    45    56    57   0.15000  1.0 3.0
   46    45    56    58   0.15000  1.0 3.0
   46    45    56    61   0.23400  1.0 3.0
   47    45    56    57   0.15000  1.0 3.0
   47    45    56    58   0.15000  1.0 3.0
   47    45    56    61   0.23400  1.0 3.0
   56    58   -63    38   0.34400  1.0 1.0
   56    58   -63    38   0.09450 -1.0 2.0
   56    58   -63    38   0.11100  1.0 3.0
   56    58    63    64   0.56750  1.0 1.0
   56    58    63    64  -0.07550 -1.0 2.0
   56    58    63    64   0.20000  1.0 3.0
   56    58    63    68   0.56750  1.0 1.0
   56    58    63    68  -0.07550 -1.0 2.0
   56    58    63    68   0.20000  1.0 3.0
   57    56    58    59   0.15000  1.0 3.0
   57    56    58    60   0.15000  1.0 3.0
   57    56    58    63   0.15000  1.0 3.0
   57    56    61    62   0.19450  1.0 3.0
   58    56    61    62  -0.11600  1.0 1.0
   58    56    61    62  -0.09450 -1.0 2.0
   58    56    61    62   0.21250  1.0 3.0
   58    63    64    65   0.15000  1.0 3.0
   58    63    64    66   0.15000  1.0 3.0
   58    63    64    67   0.15000  1.0 3.0
   58    63    68    69   0.15000  1.0 3.0
   58    63    68    70   0.15000  1.0 3.0
   58    63    68    71   0.15000  1.0 3.0
   59    58    63    38   0.15000  1.0 3.0
   59    58    63    64   0.15000  1.0 3.0
   59    58    63    68   0.15000  1.0 3.0
   60    58    63    38   0.15000  1.0 3.0
   60    58    63    64   0.15000  1.0 3.0
   60    58    63    68   0.15000  1.0 3.0
   63    38   -42    45   7.00000 -1.0 2.0
   63    38    42    48   7.00000 -1.0 2.0
   64    63    68    69   0.15000  1.0 3.0
   64    63    68    70   0.15000  1.0 3.0
   64    63    68    71   0.15000  1.0 3.0
   68    63    64    65   0.15000  1.0 3.0
   68    63    64    66   0.15000  1.0 3.0
   68    63    64    67   0.15000  1.0 3.0
   61    56    58    59   0.23400  1.0 3.0
   61    56    58    60   0.23400  1.0 3.0
   61    56    58    63   0.86500  1.0 1.0
   61    56    58    63  -0.17500 -1.0 2.0
   61    56    58    63   0.20800  1.0 3.0
   48    42    45    46   0.34800  1.0 3.0
   48    42    45    47   0.34800  1.0 3.0
   48    42    45    56   0.46850  1.0 1.0
   48    42    45    56   0.08550 -1.0 2.0
   48    42    45    56   0.09800  1.0 3.0
   39    33    38    42   0.09850  1.0 1.0
   39    33    38    42   0.15250 -1.0 2.0
   39    33    38    42  -0.50650  1.0 3.0
   39    33    38    63   0.46850  1.0 1.0
   39    33    38    63   0.08550 -1.0 2.0
   39    33    38    63   0.09800  1.0 3.0
   39    43    52    53   0.00000  1.0 1.0
   39    43    52    54   0.00000  1.0 1.0
   39    43    52    55   0.00000  1.0 1.0
   40    39    43    44   0.00000  1.0 1.0
   40    39    43    52   0.00000  1.0 1.0
   41    39    43    44   0.00000  1.0 1.0
   41    39    43    52   0.00000  1.0 1.0
   44    43    52    53   0.00000  1.0 1.0
   44    43    52    54   0.00000  1.0 1.0
   44    43    52    55   0.00000  1.0 1.0
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    63    38    42   1.10000 -1.0 2.0
   45    48    42    38   1.10000 -1.0 2.0
   39    52    43    44  10.50000 -1.0 2.0
END
