* LIGAND DATABASE FILE (OPLS2005)
*
001      67    67    113    171     329
    1     0 S   NP   _N1_     1    29.30384    93.66541   -24.50990
    2     1 S   H    _HN1     2     1.02831    18.58495   167.18490
    3     1 S   H    _H1_     3     1.02780   108.90697  -102.83544
    4     1 S   H    _H2_     4     1.02950    89.55373     6.46038
    5     1 S   CT   _CA1     5     1.50113   124.45113   121.13662
    6     5 S   HC   _HA1     6     1.09571   105.21890    73.39837
    7     5 S   CO3  _C1_     7     1.53797   112.38741   -46.87121
    8     7 S   O2Z  _O11     8     1.26373   114.99544   -43.42554
    9     7 S   O2Z  _O12     9     1.26236   114.94364   135.69769
   10     5 S   CT   _CB1    10     1.53076   107.43698  -168.59863
   11    10 S   HC   HB11    11     1.09829   109.41965   -49.61165
   12    10 S   HC   HB12    12     1.09823   110.42997    66.99860
   13    10 S   CT   _CG1    13     1.53004   112.59651  -170.60094
   14    13 S   HC   HG11    14     1.09587   110.55421   -64.01496
   15    13 S   HC   HG12    15     1.09660   109.89681    55.24801
   16    13 S   C    _CD1    16     1.51778   112.22652   175.69143
   17    16 S   O    _OE1    17     1.22729   123.19481     2.96953
   18    16 S   N    _N2_    18     1.38651   111.64907  -177.21990
   19    18 S   H    _HN2    19     1.01571   119.05554     1.52007
   20    18 S   CT1  _CA2    20     1.46168   123.34268   179.45070
   21    20 S   HC   _HA2    21     1.09507   109.25267    -4.80432
   22    20 S   C    _C2_    22     1.53464   108.39119  -119.74280
   23    22 S   O    _O2_    23     1.23034   122.44438  -146.83549
   24    20 S   CT   _CB2    32     1.53389   111.78538   117.85098
   25    24 S   HC   HB21    33     1.09678   109.35170    64.44776
   26    24 S   HC   HB22    34     1.09511   110.97972  -178.74477
   27    22 S   N    _N3_    24     1.38408   113.48135    40.39935
   28    27 S   H    _HN3    25     1.01615   119.45974    -3.14709
   29    24 S   S    _SG2    35     1.83142   114.81085   -54.59345
   30    27 S   CT   _CA3    26     1.45265   123.13739   177.03601
   31    30 S   HC   HA31    27     1.09552   107.47258   -65.07726
   32    30 S   HC   HA32    28     1.09559   108.00595    51.33047
   33    29 S   CT   _C7_    36     1.83807   100.81039   -67.02546
   34    33 S   HC   _H3_    37     1.09302   108.20468    46.87925
   35    30 S   CO3  _C3_    29     1.52935   114.15958   173.35167
   36    35 S   O2Z  _O31    30     1.26368   116.10601    -1.18333
   37    35 S   O2Z  _O32    31     1.26440   114.40178   178.91160
   38    33 S   CM   _C8_    38     1.50937   107.64332   164.38225
   39    38 S   HC   _H8_    39     1.08899   117.27862    64.08548
   40    33 S   CM   _C6_    60     1.50919   109.47923   -74.82124
   41    40 S   HC   _H7_    61     1.08972   115.79298   -59.54859
   42    38 S   CM   _C9_    40     1.34278   123.23092  -115.87671
   43    42 S   HC   _H9_    41     1.08769   119.44855    -0.02798
   44    40 S   CMA  _C5_    62     1.35187   125.45113   120.70446
   45    44 S   OM   _O33    63     1.26142   131.44452    -0.11869
   46    42 S   CM   _C10    42     1.44558   123.23534   179.62051
   47    46 S   HC   _H10    43     1.08768   117.03208     0.33220
   48    44 S   CT   _C4_    64     1.51831   117.32969   180.00000
   49    48 S   HC   _H4_    65     1.09766   111.20072   119.45233
   50    48 S   HC   _H5_    66     1.09764   111.20868  -119.51177
   51    48 S   HC   _H6_    67     1.09666   112.33391    -0.00000
   52    46 S   CM   _C11    44     1.34170   122.89823  -179.52936
   53    52 S   HC   _H11    45     1.08792   119.88478    -0.09691
   54    52 S   CM   _C12    46     1.44765   123.02312   179.85196
   55    54 S   HC   _H12    47     1.08681   116.49354    -0.45885
   56    54 S   CM   _C13    48     1.34252   122.71802  -179.82086
   57    56 S   HC   _H13    49     1.08837   119.58582     0.74625
   58    56 S   CA   _C14    50     1.47012   125.00903   179.66370
   59    58 S   CA   _C15    51     1.39875   119.43102  -156.31611
   60    59 S   HA   _H14    52     1.08771   120.75791     1.61070
   61    59 S   CA   _C16    53     1.39254   120.39181  -178.73020
   62    61 S   HA   _H15    54     1.08408   120.95100  -179.58931
   63    61 S   CA   _C17    55     1.38339   118.02465     0.49138
   64    63 S   HA   _H16    56     1.08509   120.89907  -179.96574
   65    63 S   NB   _N4_    57     1.34958   123.85300     0.24866
   66    58 S   CA   _C18    58     1.39313   123.95730    26.31412
   67    66 S   HA   _H17    59     1.08590   121.79985    -0.70081
  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
  11   6   2   1   1   9   4   8   3   6   3   5   4   6   3   3
   2   1   1   6   3   6   3   8   3   8   8   4   5   3   4   2
   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    46    40    41    44    45    48  
   38    39    42    40    41    44  
   36    37  
   37  
    0  
   39    42    43    46    47    52    40    41    44  
   42    43    46    40  
   41    44    45    48    49    50    51    42  
   44    45    48  
   43    46    47    52    53    54  
   46    47    52  
   45    48    49    50    51  
   48    49    50    51  
   47    52    53    54    55    56  
   52    53    54  
   49    50    51  
   50    51  
   51  
    0  
   53    54    55    56    57    58  
   54    55    56  
   55    56    57    58    59    66  
   56    57    58  
   57    58    59    60    61    65    66    67  
   58    59    66  
   59    60    61    62    63    65    66    67  
   60    61    62    63    64    65    66    67  
   61    62    63    66  
   62    63    64    65    66  
   63    64    65  
   64    65    66    67  
   65    66  
   66    67  
   67  
    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  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0700  -0.292000   2.0020   1.7750   0.001000000  -0.843144165
   59   3.5500   0.0700   0.227000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.065000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700  -0.447000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.155000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5500   0.0700   0.473000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.012000   1.3810   1.2100   0.030040813   0.268726247
   65   3.2500   0.1700  -0.678000   1.8650   1.6500   0.001000000  -0.511443539
   66   3.5500   0.0700   0.473000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.012000   1.3810   1.2100   0.030040813   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    40   317.000  1.510
   38    39   340.000  1.080
   38    42   549.000  1.340
   42    43   340.000  1.080
   42    46   380.000  1.444
   46    47   340.000  1.080
   46    52   549.000  1.340
   52    53   340.000  1.080
   52    54   380.000  1.444
   54    55   340.000  1.080
   54    56   549.000  1.340
   56    57   340.000  1.080
   56    58   320.000  1.460
   58    59   469.000  1.400
   58    66   469.000  1.400
   59    60   367.000  1.080
   59    61   469.000  1.400
   61    62   367.000  1.080
   61    63   469.000  1.400
   63    64   367.000  1.080
   63    65   483.000  1.339
   65    66   483.000  1.339
   66    67   367.000  1.080
   40    41   340.000  1.080
   40    44   465.000  1.376
   44    45   745.000  1.250
   44    48   270.000  1.512
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   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    40    75.00000  112.20000
   33    38    39    35.00000  117.00000
   33    38    42    70.00000  124.00000
   33    40    41    35.00000  117.00000
   33    40    44    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    46    70.00000  123.01800
   42    38    39    35.00000  120.00000
   42    46    47    35.00000  120.00000
   42    46    52    70.00000  123.01800
   46    42    43    35.00000  120.00000
   46    52    53    35.00000  120.00000
   46    52    54    70.00000  123.01800
   52    46    47    35.00000  120.00000
   52    54    55    35.00000  120.00000
   52    54    56    70.00000  123.01800
   54    52    53    35.00000  120.00000
   54    56    57    35.00000  120.00000
   54    56    58    60.00000  123.20500
   56    54    55    35.00000  120.00000
   56    58    59    60.00000  120.93500
   56    58    66    60.00000  120.93500
   58    56    57    40.00000  117.26300
   58    59    60    35.00000  120.00000
   58    59    61    63.00000  120.00000
   58    66    65    70.00000  124.00000
   58    66    67    35.00000  120.00000
   59    61    62    35.00000  120.00000
   59    61    63    63.00000  120.00000
   61    59    60    35.00000  120.00000
   61    63    64    35.00000  120.00000
   61    63    65    70.00000  124.00000
   63    61    62    35.00000  120.00000
   63    65    66    70.00000  117.00000
   65    63    64    35.00000  116.00000
   65    66    67    35.00000  116.00000
   66    58    59    63.00000  120.00000
   40    33    34    35.00000  109.50000
   40    33    38    70.00000  110.12100
   40    44    45    65.00000  137.10300
   40    44    48    65.00000  122.18000
   44    40    41    40.00000  120.50800
   44    48    49    45.00000  110.52000
   44    48    50    45.00000  110.52000
   44    48    51    45.00000  110.52000
   48    44    45    85.00000  112.85300
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    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    40  -0.62250  1.0 1.0
   24    29    33    40  -0.38450 -1.0 2.0
   24    29    33    40   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   0.00000  1.0 1.0
   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    40    41   0.00000  1.0 1.0
   29    33    40    44   0.42700  1.0 1.0
   29    33    40    44  -0.70350 -1.0 2.0
   29    33    40    44  -0.43150  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    46   7.00000 -1.0 2.0
   33    40    44    45   7.00000 -1.0 2.0
   33    40    44    48   7.00000 -1.0 2.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    40    41   0.33100  1.0 3.0
   34    33    40    44   0.00000  1.0 1.0
   38    33    40    41   0.00000  1.0 1.0
   38    33    40    44  -0.28300  1.0 1.0
   38    33    40    44   0.26700 -1.0 2.0
   38    33    40    44  -0.63300  1.0 3.0
   38    42    46    47  -0.18600  1.0 3.0
   38    42    46    52   0.28850  1.0 1.0
   38    42    46    52   2.61350 -1.0 2.0
   38    42    46    52   0.78400  1.0 3.0
   39    38    42    43   7.00000 -1.0 2.0
   39    38    42    46   7.00000 -1.0 2.0
   42    46    52    53   7.00000 -1.0 2.0
   42    46    52    54   7.00000 -1.0 2.0
   43    42    46    47   0.00000  1.0 1.0
   43    42    46    52  -0.18600  1.0 3.0
   46    52    54    55  -0.18600  1.0 3.0
   46    52    54    56   0.28850  1.0 1.0
   46    52    54    56   2.61350 -1.0 2.0
   46    52    54    56   0.78400  1.0 3.0
   47    46    52    53   7.00000 -1.0 2.0
   47    46    52    54   7.00000 -1.0 2.0
   52    54    56    57   7.00000 -1.0 2.0
   52    54    56    58   7.00000 -1.0 2.0
   53    52    54    55   0.00000  1.0 1.0
   53    52    54    56  -0.18600  1.0 3.0
   54    56    58    59   0.15800  1.0 1.0
   54    56    58    59   1.85350 -1.0 2.0
   54    56    58    59  -0.48700  1.0 3.0
   54    56    58    66   0.15800  1.0 1.0
   54    56    58    66   1.85350 -1.0 2.0
   54    56    58    66  -0.48700  1.0 3.0
   55    54    56    57   7.00000 -1.0 2.0
   55    54    56    58   7.00000 -1.0 2.0
   56    58    59    60   3.62500 -1.0 2.0
   56    58    59    61   3.62500 -1.0 2.0
   56    58    66    65   3.62500 -1.0 2.0
   56    58    66    67   3.62500 -1.0 2.0
   57    56    58    59   0.56550  1.0 3.0
   57    56    58    66   0.56550  1.0 3.0
   58    59    61    62   3.62500 -1.0 2.0
   58    59    61    63   3.62500 -1.0 2.0
   59    58    66    65   3.62500 -1.0 2.0
   59    58    66    67   3.62500 -1.0 2.0
   59    61    63    64   3.62500 -1.0 2.0
   59    61   -63    65   3.62500 -1.0 2.0
   60    59    61    62   3.62500 -1.0 2.0
   60    59    61    63   3.62500 -1.0 2.0
   61    63    65    66   3.62500 -1.0 2.0
   62    61    63    64   3.62500 -1.0 2.0
   62    61    63    65   3.62500 -1.0 2.0
   63    65   -66    58   3.62500 -1.0 2.0
   63    65    66    67   3.62500 -1.0 2.0
   64    63    65    66   3.62500 -1.0 2.0
   66    58    59    60   3.62500 -1.0 2.0
   66    58   -59    61   3.62500 -1.0 2.0
   40    33    38    39   0.00000  1.0 1.0
   40    33    38    42  -0.28300  1.0 1.0
   40    33    38    42   0.26700 -1.0 2.0
   40    33    38    42  -0.63300  1.0 3.0
   40    44    48    49   0.00000  1.0 1.0
   40    44    48    50   0.00000  1.0 1.0
   40    44    48    51   0.00000  1.0 1.0
   41    40    44    45   7.00000 -1.0 2.0
   41    40    44    48   7.00000 -1.0 2.0
   45    44    48    49   0.00000  1.0 1.0
   45    44    48    50   0.00000  1.0 1.0
   45    44    48    51   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    39    38    42  15.00000 -1.0 2.0
   46    43    42    38  15.00000 -1.0 2.0
   42    47    46    52  15.00000 -1.0 2.0
   54    53    52    46  15.00000 -1.0 2.0
   52    55    54    56  15.00000 -1.0 2.0
   58    57    56    54  15.00000 -1.0 2.0
   59    66    58    56   4.00000 -1.0 2.0
   61    60    59    58   1.10000 -1.0 2.0
   63    62    61    59   1.10000 -1.0 2.0
   65    64    63    61   1.10000 -1.0 2.0
   65    67    66    58   1.10000 -1.0 2.0
   33    41    40    44  15.00000 -1.0 2.0
   48    45    44    40  15.00000 -1.0 2.0
END
