* LIGAND DATABASE FILE (OPLS2005)
*
001      72    72    126    189     369
    1     0 S   NP   _N1_     1    28.76019    96.05809   -25.19511
    2     1 S   H    _HN1     2     1.02950    70.11618    18.35631
    3     1 S   H    _H1_     3     1.02827    37.35965  -170.36312
    4     1 S   H    _H2_     4     1.02785   114.94292   -83.26500
    5     1 S   CT   _CA1     5     1.50116   129.66738   118.80358
    6     5 S   HC   _HA1     6     1.09574   105.18960    97.03478
    7     5 S   CO3  _C1_     7     1.53779   112.46492   -23.18753
    8     7 S   O2Z  _O11     8     1.26372   114.99990   -42.41541
    9     7 S   O2Z  _O12     9     1.26239   114.93889   136.69273
   10     5 S   CT   _CB1    10     1.53074   107.41482  -144.99264
   11    10 S   HC   HB11    11     1.09834   109.34505   -49.79395
   12    10 S   HC   HB12    12     1.09813   110.45835    66.80547
   13    10 S   CT   _CG1    13     1.52993   112.62010  -170.77563
   14    13 S   HC   HG11    14     1.09581   110.64080   -66.15642
   15    13 S   HC   HG12    15     1.09671   109.77761    53.08154
   16    13 S   C    _CD1    16     1.51802   112.19618   173.51929
   17    16 S   O    _OE1    17     1.22734   123.27951     7.63450
   18    16 S   N    _N2_    18     1.38650   111.69351  -172.45730
   19    18 S   H    _HN2    19     1.01582   118.93860     1.47167
   20    18 S   CT1  _CA2    20     1.46214   123.38281   177.14638
   21    20 S   HC   _HA2    21     1.09737   109.37084     2.45447
   22    20 S   C    _C2_    22     1.53549   108.48383  -112.98352
   23    22 S   O    _O2_    23     1.23045   122.33443  -147.34777
   24    20 S   CT   _CB2    32     1.53310   111.63404   124.48815
   25    24 S   HC   HB21    33     1.09583   110.09848    56.35749
   26    24 S   HC   HB22    34     1.09458   109.96223   175.47511
   27    22 S   N    _N3_    24     1.38347   113.66303    40.06505
   28    27 S   H    _HN3    25     1.01583   119.58978    -3.28765
   29    24 S   S    _SG2    35     1.82854   111.43514   -64.52854
   30    27 S   CT   _CA3    26     1.45286   123.21940   177.16220
   31    30 S   HC   HA31    27     1.09549   107.50744   -64.67967
   32    30 S   HC   HA32    28     1.09556   107.99144    51.76334
   33    29 S   CT   _C11    36     1.85593    99.65522   173.55384
   34    33 S   HC   _H4_    37     1.09813   105.78466   -47.61394
   35    30 S   CO3  _C3_    29     1.52963   114.06987   173.75879
   36    35 S   O2Z  _O31    30     1.26377   116.06678    -0.75666
   37    35 S   O2Z  _O32    31     1.26427   114.41508   179.30536
   38    33 S   CA   _C12    38     1.52121   110.06878    70.54105
   39    33 S   CT   _C9_    52     1.55852   110.63611  -164.65586
   40    39 S   HC   _H3_    53     1.09317   108.47330   -60.09981
   41    38 S   CA   _C13    39     1.39641   122.19151    65.06556
   42    41 S   HA   _H15    40     1.08751   120.28420    -1.09754
   43    39 S   CZ   _C10    54     1.47909   111.14045    60.42660
   44    43 S   NZ   _N5_    55     1.16050   179.57942  -175.36173
   45    39 S   C    _C8_    56     1.53739   110.68534   178.88513
   46    45 S   O    _O33    57     1.23637   119.64185   -36.01491
   47    41 S   CA   _C14    41     1.40679   119.81012   179.03836
   48    45 S   N    _N4_    58     1.39987   118.02159   145.72056
   49    47 S   CA   _C15    42     1.41481   125.12633     0.11703
   50    49 S   OM   _O35    43     1.28023   125.07478  -179.59846
   51    47 S   NO2  _N6_    49     1.45051   115.32116  -179.52729
   52    51 S   ON   _O37    50     1.23851   116.85916    83.03411
   53    51 S   ON   _O36    51     1.23826   117.04736   -94.99402
   54    48 S   CT   _C5_    59     1.46690   118.22359  -177.20544
   55    54 S   HC   _H8_    60     1.09586   109.21349    31.08368
   56    54 S   HC   _H9_    61     1.09520   109.10004   147.84985
   57    48 S   CT   _C6_    66     1.46957   125.47534     4.84339
   58    57 S   HC   _H10    67     1.09267   110.27717    27.21524
   59    57 S   HC   _H11    68     1.09584   108.42254   143.21713
   60    49 S   CA   _C16    44     1.41390   112.21364     0.22555
   61    54 S   CT   _C4_    62     1.52081   111.76970   -89.68098
   62    61 S   HC   _H5_    63     1.09461   111.21722   -60.53825
   63    61 S   HC   _H6_    64     1.09489   111.10710    59.41342
   64    61 S   HC   _H7_    65     1.09428   110.30543   179.43352
   65    57 S   CT   _C7_    69     1.52058   111.98183   -95.43328
   66    65 S   HC   _H12    70     1.09459   111.24188   -60.17794
   67    65 S   HC   _H13    71     1.09319   111.38613    59.82249
   68    65 S   HC   _H14    72     1.09430   110.25814   179.92598
   69    38 S   CA   _C17    45     1.39777   119.99054  -115.50093
   70    69 S   HA   _H16    46     1.08767   120.34139     0.48214
   71    60 S   OH   _O34    47     1.37987   119.62418   179.91377
   72    71 S   HO   _H17    48     0.97520   105.74718    -0.11869
  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  13  10   5  10   4   4   1  10   3   8  14
   9   4   3   1   1  10   6   5   7   5   4   4   3   2   1   1
   3   2   1   1   3   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    69    39    40    43    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    47    60    69    70    39    40    43    44    45    46    48  
   38    41    69    39    40    43    45  
   36    37  
   37  
    0  
   41    42    47    49    60    69    70    71    51    39    40    43    45  
   40    43    44    45    46    48    54    57    41    69  
   43    44    45    46    48  
   42    47    49    50    60    69    70    51    52    53  
   47    49    69    51  
   44    45    46    48  
   45  
   46    48    54    55    56    61    57    58    59    65  
   48    54    57  
   49    50    60    69    71    51    52    53  
   54    55    56    61    62    63    64    57    58    59    65    66    67    68  
   50    60    69    70    71    72    51    52    53  
   60    69    71    51  
   52    53    60  
   53  
    0  
   55    56    61    62    63    64    57    58    59    65  
   56    61    62    63    64    57  
   61    62    63    64    57  
   58    59    65    66    67    68    61  
   59    65    66    67    68  
   65    66    67    68  
   69    70    71    72  
   62    63    64  
   63    64  
   64  
    0  
   66    67    68  
   67    68  
   68  
    0  
   70    71    72  
   71  
   72  
    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   0.222500   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.3000   0.0660   0.040000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.3000   0.0660   0.460000   2.0580   1.8250   0.025318638  -1.264311570
   44   3.2800   0.1700  -0.560000   2.2500   2.0000   0.024786691  -1.117108600
   45   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   47   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.2500   0.1700  -0.140000   1.8100   1.6000   0.054801302  -1.445846770
   49   3.5500   0.0700  -0.170000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   51   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   52   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   53   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   54   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   57   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   70   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   71   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   72   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    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    41   469.000  1.400
   38    69   469.000  1.400
   41    42   367.000  1.080
   41    47   469.000  1.400
   47    49   469.000  1.400
   47    51   400.000  1.460
   49    50   450.000  1.364
   49    60   469.000  1.400
   60    69   469.000  1.400
   60    71   450.000  1.364
   69    70   367.000  1.080
   71    72   553.000  0.945
   51    52   550.000  1.225
   51    53   550.000  1.225
   39    40   340.000  1.090
   39    43   390.000  1.470
   39    45   317.000  1.522
   43    44   650.000  1.157
   45    46   570.000  1.229
   45    48   490.000  1.335
   48    54   337.000  1.449
   48    57   337.000  1.449
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    65   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   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    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    41    70.00000  120.00000
   33    38    69    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    43    58.35000  112.70000
   33    39    45    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    47    63.00000  120.00000
   38    69    60    63.00000  120.00000
   38    69    70    35.00000  120.00000
   41    47    49    63.00000  120.00000
   41    47    51    85.00000  120.00000
   47    41    42    35.00000  120.00000
   47    49    50    70.00000  120.00000
   47    49    60    63.00000  120.00000
   47    51    52    80.00000  117.50000
   47    51    53    80.00000  117.50000
   49    60    69    63.00000  120.00000
   49    60    71    70.00000  120.00000
   60    49    50    70.00000  120.00000
   60    69    70    35.00000  120.00000
   60    71    72    35.00000  113.00000
   69    38    41    63.00000  120.00000
   71    60    69    70.00000  120.00000
   51    47    49    85.00000  120.00000
   53    51    52    80.00000  125.30000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    43    44   150.00000  180.00000
   39    45    46    80.00000  120.40000
   39    45    48    70.00000  116.60000
   43    39    40    35.00000  108.50000
   45    39    40    35.00000  109.50000
   45    39    43    70.00000  111.78000
   45    48    54    50.00000  121.90000
   45    48    57    50.00000  121.90000
   48    45    46    80.00000  122.90000
   48    54    55    35.00000  109.50000
   48    54    56    35.00000  109.50000
   48    54    61    70.00000  110.72300
   48    57    58    35.00000  109.50000
   48    57    59    35.00000  109.50000
   48    57    65    70.00000  110.72300
   54    61    62    37.50000  110.70000
   54    61    63    37.50000  110.70000
   54    61    64    37.50000  110.70000
   56    54    55    33.00000  107.80000
   61    54    55    37.50000  110.70000
   61    54    56    37.50000  110.70000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   57    48    54    50.00000  118.00000
   57    65    66    37.50000  110.70000
   57    65    67    37.50000  110.70000
   57    65    68    37.50000  110.70000
   59    57    58    33.00000  107.80000
   65    57    58    37.50000  110.70000
   65    57    59    37.50000  110.70000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  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    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    69  -0.16000  1.0 1.0
   29    33    38    69  -0.03200 -1.0 2.0
   29    33    38    69   0.04500  1.0 3.0
   29    33    39    40   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
   29    33    39    45   0.56750  1.0 1.0
   29    33    39    45  -0.07550 -1.0 2.0
   29    33    39    45   0.20000  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    47   3.62500 -1.0 2.0
   33    38    69    60   3.62500 -1.0 2.0
   33    38    69    70   3.62500 -1.0 2.0
   33    39    43    44   0.00000  1.0 1.0
   33    39    45    46   0.30150 -1.0 2.0
   33    39    45    48   1.39750  1.0 1.0
   33    39    45    48  -0.07950 -1.0 2.0
   33    39    45    48  -0.18750  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    69   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    43   0.15000  1.0 3.0
   34    33    39    45  -0.11250  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    43   0.56750  1.0 1.0
   38    33    39    43  -0.07550 -1.0 2.0
   38    33    39    43   0.20000  1.0 3.0
   38    33    39    45   0.56750  1.0 1.0
   38    33    39    45  -0.07550 -1.0 2.0
   38    33    39    45   0.20000  1.0 3.0
   38    41    47    49   3.62500 -1.0 2.0
   38    41    47    51   3.62500 -1.0 2.0
   41    38    69    60   3.62500 -1.0 2.0
   41    38    69    70   3.62500 -1.0 2.0
   41    47    49    50   3.62500 -1.0 2.0
   41    47   -49    60   3.62500 -1.0 2.0
   41    47    51    52   0.69950 -1.0 2.0
   41    47    51    53   0.69950 -1.0 2.0
   42    41    47    49   3.62500 -1.0 2.0
   42    41    47    51   3.62500 -1.0 2.0
   47    49    60    69   3.62500 -1.0 2.0
   47    49    60    71   3.62500 -1.0 2.0
   49    47    51    52   0.69950 -1.0 2.0
   49    47    51    53   0.69950 -1.0 2.0
   49    60   -69    38   3.62500 -1.0 2.0
   49    60    69    70   3.62500 -1.0 2.0
   49    60    71    72   0.84100 -1.0 2.0
   50    49    60    69   3.62500 -1.0 2.0
   50    49    60    71   3.62500 -1.0 2.0
   69    38    41    42   3.62500 -1.0 2.0
   69    38   -41    47   3.62500 -1.0 2.0
   69    60    71    72   0.84100 -1.0 2.0
   71    60    69    38   3.62500 -1.0 2.0
   71    60    69    70   3.62500 -1.0 2.0
   51    47    49    50   3.62500 -1.0 2.0
   51    47    49    60   3.62500 -1.0 2.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33    38    69   0.04150 -1.0 2.0
   39    45    48    54   1.49850  1.0 1.0
   39    45    48    54   1.53950 -1.0 2.0
   39    45    48    57   1.49850  1.0 1.0
   39    45    48    57   1.53950 -1.0 2.0
   40    39    43    44   0.00000  1.0 1.0
   40    39    45    46   0.00000  1.0 1.0
   40    39    45    48   0.00000  1.0 1.0
   43    39    45    46   0.30150 -1.0 2.0
   43    39    45    48   0.00000  1.0 1.0
   45    39    43    44   0.00000  1.0 1.0
   45    48    54    55   0.00000  1.0 1.0
   45    48    54    56   0.00000  1.0 1.0
   45    48    54    61  -0.43950  1.0 1.0
   45    48    54    61  -0.08100 -1.0 2.0
   45    48    54    61   0.03350  1.0 3.0
   45    48    57    58   0.00000  1.0 1.0
   45    48    57    59   0.00000  1.0 1.0
   45    48    57    65  -0.43950  1.0 1.0
   45    48    57    65  -0.08100 -1.0 2.0
   45    48    57    65   0.03350  1.0 3.0
   46    45    48    54   3.04450 -1.0 2.0
   46    45    48    57   3.04450 -1.0 2.0
   48    54    61    62   0.15000  1.0 3.0
   48    54    61    63   0.15000  1.0 3.0
   48    54    61    64   0.15000  1.0 3.0
   48    57    65    66   0.15000  1.0 3.0
   48    57    65    67   0.15000  1.0 3.0
   48    57    65    68   0.15000  1.0 3.0
   54    48    57    58   0.00000  1.0 1.0
   54    48    57    59   0.00000  1.0 1.0
   54    48    57    65  -0.05900 -1.0 2.0
   55    54    61    62   0.15000  1.0 3.0
   55    54    61    63   0.15000  1.0 3.0
   55    54    61    64   0.15000  1.0 3.0
   56    54    61    62   0.15000  1.0 3.0
   56    54    61    63   0.15000  1.0 3.0
   56    54    61    64   0.15000  1.0 3.0
   57    48    54    55   0.00000  1.0 1.0
   57    48    54    56   0.00000  1.0 1.0
   57    48    54    61  -0.05900 -1.0 2.0
   58    57    65    66   0.15000  1.0 3.0
   58    57    65    67   0.15000  1.0 3.0
   58    57    65    68   0.15000  1.0 3.0
   59    57    65    66   0.15000  1.0 3.0
   59    57    65    67   0.15000  1.0 3.0
   59    57    65    68   0.15000  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
   41    69    38    33   4.00000 -1.0 2.0
   47    42    41    38   1.10000 -1.0 2.0
   49    51    47    41   4.00000 -1.0 2.0
   60    50    49    47   4.00000 -1.0 2.0
   69    71    60    49   4.00000 -1.0 2.0
   60    70    69    38   1.10000 -1.0 2.0
   52    47    51    53  10.50000 -1.0 2.0
   39    48    45    46  10.50000 -1.0 2.0
   57    45    48    54   1.00000 -1.0 2.0
END
