* LIGAND DATABASE FILE (OPLS2005)
*
001      72    72    123    183     357
    1     0 S   NP   _N1_     1    28.69674    97.53449   -23.37792
    2     1 S   H    _HN1     2     1.02947    65.88830    -1.09146
    3     1 S   H    _H1_     3     1.02827    42.99519   161.15570
    4     1 S   H    _H2_     4     1.02795   109.40027  -103.12470
    5     1 S   CT   _CA1     5     1.50127   136.74997    93.62408
    6     5 S   HC   _HA1     6     1.09574   105.16095   101.66429
    7     5 S   CO3  _C1_     7     1.53769   112.44130   -18.54173
    8     7 S   O2Z  _O11     8     1.26377   115.00592   -43.04238
    9     7 S   O2Z  _O12     9     1.26234   114.94389   135.94081
   10     5 S   CT   _CB1    10     1.53056   107.39962  -140.37823
   11    10 S   HC   HB11    11     1.09842   109.33220   -49.35347
   12    10 S   HC   HB12    12     1.09810   110.48190    67.24202
   13    10 S   CT   _CG1    13     1.53020   112.63523  -170.27838
   14    13 S   HC   HG11    14     1.09569   110.73580   -67.32836
   15    13 S   HC   HG12    15     1.09670   109.69110    51.91623
   16    13 S   C    _CD1    16     1.51820   111.96964   172.40849
   17    16 S   O    _OE1    17     1.22762   123.14929    12.66048
   18    16 S   N    _N2_    18     1.38620   111.82067  -167.28746
   19    18 S   H    _HN2    19     1.01575   119.10865     0.73061
   20    18 S   CT1  _CA2    20     1.46290   123.47198   176.92184
   21    20 S   HC   _HA2    21     1.09742   109.13473     9.68686
   22    20 S   C    _C2_    22     1.53791   109.40791  -105.85311
   23    22 S   O    _O2_    23     1.23100   122.18482  -153.58942
   24    20 S   CT   _CB2    32     1.53427   111.40520   131.54122
   25    24 S   HC   HB21    33     1.09519   109.57473    56.70687
   26    24 S   HC   HB22    34     1.09452   109.92439   175.59816
   27    22 S   N    _N3_    24     1.38300   114.09841    33.97831
   28    27 S   H    _HN3    25     1.01510   119.57788    -3.60907
   29    24 S   S    _SG2    35     1.83416   111.01522   -64.85933
   30    27 S   CT   _CA3    26     1.45264   123.31353   177.13351
   31    30 S   HC   HA31    27     1.09547   107.55346   -63.99626
   32    30 S   HC   HA32    28     1.09555   107.96189    52.46662
   33    29 S   CT   _C8_    36     1.86603   101.27292   169.70759
   34    33 S   OM   _O36    37     1.31297   109.66937   -68.35520
   35    30 S   CO3  _C3_    29     1.52973   114.02399   174.44575
   36    35 S   O2Z  _O31    30     1.26388   116.08524     0.11014
   37    35 S   O2Z  _O32    31     1.26425   114.41775  -179.83929
   38    33 S   CM   _C9_    38     1.52450   108.34415    59.31073
   39    38 S   HC   _H11    39     1.09458   111.84000    64.30444
   40    33 S   S    _S1_    58     1.87603   105.88198   174.12017
   41    38 S   CMA  _C10    40     1.35749   132.38214  -116.11437
   42    41 S   OM   _O35    41     1.26074   133.41464     3.11872
   43    40 S   CT   _C7_    59     1.83413   101.25746   179.78694
   44    43 S   HC   _H9_    60     1.09332   110.58286    40.01384
   45    43 S   HC   _H10    61     1.09440   108.33394   -78.88661
   46    41 S   CM   _C11    42     1.46837   117.24734  -177.85506
   47    46 S   HC   _H12    43     1.08912   115.92065  -125.13955
   48    43 S   CT   _C6_    62     1.52755   110.52465   161.26898
   49    48 S   HC   _H7_    63     1.09583   109.18332   173.32089
   50    48 S   HC   _H8_    64     1.09546   111.59560    54.39575
   51    46 S   CM   _C12    44     1.34601   123.62034    56.65638
   52    51 S   HC   _H13    45     1.08807   119.09409     0.99662
   53    48 S   N    _N4_    65     1.45409   112.23735   -66.62475
   54    53 S   H    _H6_    66     1.01513   117.48599    88.93690
   55    51 S   CA   _C13    46     1.47136   125.51049   179.40324
   56    53 S   C    _C5_    67     1.38282   122.93138   -86.85517
   57    56 S   O    _O33    68     1.22789   125.55526    -1.77740
   58    55 S   CA   _C14    47     1.40278   122.86245    28.39441
   59    58 S   HA   _H14    48     1.08715   121.03158    -0.97759
   60    56 S   CT   _C4_    69     1.50463   112.49340   176.91054
   61    60 S   HC   _H3_    70     1.09371   110.49408    45.26430
   62    60 S   HC   _H4_    71     1.09352   109.63065   164.93933
   63    60 S   HC   _H5_    72     1.09345   109.35014   -75.29253
   64    58 S   CA   _C15    49     1.39726   120.63101   178.43489
   65    64 S   HA   _H15    50     1.08630   119.77744   179.80317
   66    64 S   CA   _C16    51     1.39087   119.73206    -0.50319
   67    66 S   CA   _C17    52     1.39144   120.65153    -0.19881
   68    67 S   HA   _H16    53     1.08593   121.05771  -179.69868
   69    66 S   OH   _O34    56     1.36600   118.24253  -179.96574
   70    69 S   HO   _H18    57     0.97238   108.54759  -179.92087
   71    55 S   CA   _C18    54     1.40426   118.44179  -154.34191
   72    71 S   HA   _H17    55     1.08843   120.47780     1.81208
  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   7   5   4   3
  11   5   2   1   1   8   4   8   6   3   8   5   4   6   3   7
   4   3   8   3   7   3   9   5   4   8   4   3   2   1   1   7
   3   6   5   3   2   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    46    40    43    44    45    48  
   38    39    41    40    43  
   36    37  
   37  
    0  
   39    41    42    46    47    51    40    43  
   41    42    46    40  
   43    44    45    48    49    50    53    41  
   42    46    47    51    52    55  
   46    47    51  
   44    45    48    49    50    53    54    56  
   45    48    49    50    53  
   48    49    50    53  
   47    51    52    55    58    71  
   51    52    55  
   49    50    53    54    56    57    60  
   50    53    54    56  
   53    54    56  
   52    55    58    59    64    67    71    72  
   55    58    71  
   54    56    57    60    61    62    63  
   56    57    60  
   58    59    64    65    66    67    68    71    72  
   57    60    61    62    63  
   60    61    62    63  
   59    64    65    66    67    71    72    69  
   64    65    66    71  
   61    62    63  
   62    63  
   63  
    0  
   65    66    67    68    71    69    70  
   66    67    69  
   67    68    71    72    69    70  
   68    71    72    69    70  
   71    72    69  
   70    71  
    0  
   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  -0.175000   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   4.2000   0.3000  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   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  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   41   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760  -0.716200   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   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   54   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   55   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   67   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   68   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   69   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   71   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   72   2.4200   0.0300   0.115000   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   570.000  1.307
   33    38   317.000  1.510
   33    40   222.000  1.810
   38    39   340.000  1.080
   38    41   465.000  1.376
   41    42   745.000  1.250
   41    46   465.000  1.376
   46    47   340.000  1.080
   46    51   549.000  1.340
   51    52   340.000  1.080
   51    55   320.000  1.460
   55    58   469.000  1.400
   55    71   469.000  1.400
   58    59   367.000  1.080
   58    64   469.000  1.400
   64    65   367.000  1.080
   64    66   469.000  1.400
   66    67   469.000  1.400
   66    69   450.000  1.364
   67    68   367.000  1.080
   67    71   469.000  1.400
   71    72   367.000  1.080
   69    70   553.000  0.945
   40    43   222.000  1.810
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    48   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    53   337.000  1.449
   53    54   434.000  1.010
   53    56   490.000  1.335
   56    57   570.000  1.229
   56    60   317.000  1.522
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   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    85.00000  114.68000
   29    33    38    75.00000  112.20000
   29    33    40    75.00000  118.28000
   33    38    39    35.00000  117.00000
   33    38    41    70.00000  124.00000
   33    40    43    62.00000   98.90000
   38    33    34    85.00000  110.90400
   38    41    42    65.00000  137.10300
   38    41    46    70.00000  123.01800
   41    38    39    40.00000  120.50800
   41    46    47    40.00000  120.50800
   41    46    51    70.00000  117.34000
   46    41    42    65.00000  137.10300
   46    51    52    35.00000  120.00000
   46    51    55    60.00000  123.20500
   51    46    47    35.00000  120.00000
   51    55    58    60.00000  120.93500
   51    55    71    60.00000  120.93500
   55    51    52    40.00000  117.26300
   55    58    59    35.00000  120.00000
   55    58    64    63.00000  120.00000
   55    71    67    63.00000  120.00000
   55    71    72    35.00000  120.00000
   58    64    65    35.00000  120.00000
   58    64    66    63.00000  120.00000
   64    58    59    35.00000  120.00000
   64    66    67    63.00000  120.00000
   64    66    69    70.00000  120.00000
   66    64    65    35.00000  120.00000
   66    67    68    35.00000  120.00000
   66    67    71    63.00000  120.00000
   66    69    70    35.00000  113.00000
   67    71    72    35.00000  120.00000
   71    55    58    63.00000  120.00000
   71    67    68    35.00000  120.00000
   69    66    67    70.00000  120.00000
   40    33    34    85.00000  114.68000
   40    33    38    75.00000  112.20000
   40    43    44    35.00000  109.50000
   40    43    45    35.00000  109.50000
   40    43    48    75.00000  111.63000
   43    48    49    37.50000  110.70000
   43    48    50    37.50000  110.70000
   43    48    53    70.00000  110.72300
   45    43    44    33.00000  107.80000
   48    43    44    37.50000  110.70000
   48    43    45    37.50000  110.70000
   48    53    54    38.00000  118.40000
   48    53    56    50.00000  121.90000
   50    48    49    33.00000  107.80000
   53    48    49    35.00000  109.50000
   53    48    50    35.00000  109.50000
   53    56    57    80.00000  122.90000
   53    56    60    70.00000  116.60000
   56    53    54    35.00000  119.80000
   56    60    61    35.00000  109.50000
   56    60    62    35.00000  109.50000
   56    60    63    35.00000  109.50000
   60    56    57    80.00000  120.40000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  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   0.08500  1.0 1.0
   24    29    33    40  -0.53150 -1.0 2.0
   24    29    33    40   0.48050  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    41   0.42700  1.0 1.0
   29    33    38    41  -0.70350 -1.0 2.0
   29    33    38    41  -0.43150  1.0 3.0
   29    33    40    43   0.08500  1.0 1.0
   29    33    40    43  -0.53150 -1.0 2.0
   29    33    40    43   0.48050  1.0 3.0
   33    38    41    42   7.00000 -1.0 2.0
   33    38    41    46   7.00000 -1.0 2.0
   33    40    43    44   0.32350  1.0 3.0
   33    40    43    45   0.32350  1.0 3.0
   33    40    43    48   0.01700  1.0 1.0
   33    40    43    48  -0.23550 -1.0 2.0
   33    40    43    48   0.21350  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    41   0.39000  1.0 1.0
   34    33    38    41  -0.05800 -1.0 2.0
   34    33    38    41  -0.55150  1.0 3.0
   34    33    40    43   0.13850  1.0 1.0
   34    33    40    43  -1.34450 -1.0 2.0
   34    33    40    43   0.57400  1.0 3.0
   38    33    40    43  -0.62250  1.0 1.0
   38    33    40    43  -0.38450 -1.0 2.0
   38    33    40    43   0.81900  1.0 3.0
   38    41    46    47   7.00000 -1.0 2.0
   38    41    46    51   7.00000 -1.0 2.0
   39    38    41    42   7.00000 -1.0 2.0
   39    38    41    46   7.00000 -1.0 2.0
   41    46    51    52   7.00000 -1.0 2.0
   41    46    51    55   7.00000 -1.0 2.0
   42    41    46    47   7.00000 -1.0 2.0
   42    41    46    51   7.00000 -1.0 2.0
   46    51    55    58   0.15800  1.0 1.0
   46    51    55    58   1.85350 -1.0 2.0
   46    51    55    58  -0.48700  1.0 3.0
   46    51    55    71   0.15800  1.0 1.0
   46    51    55    71   1.85350 -1.0 2.0
   46    51    55    71  -0.48700  1.0 3.0
   47    46    51    52   7.00000 -1.0 2.0
   47    46    51    55   7.00000 -1.0 2.0
   51    55    58    59   3.62500 -1.0 2.0
   51    55    58    64   3.62500 -1.0 2.0
   51    55    71    67   3.62500 -1.0 2.0
   51    55    71    72   3.62500 -1.0 2.0
   52    51    55    58   0.56550  1.0 3.0
   52    51    55    71   0.56550  1.0 3.0
   55    58    64    65   3.62500 -1.0 2.0
   55    58    64    66   3.62500 -1.0 2.0
   58    55    71    67   3.62500 -1.0 2.0
   58    55    71    72   3.62500 -1.0 2.0
   58    64   -66    67   3.62500 -1.0 2.0
   58    64    66    69   3.62500 -1.0 2.0
   59    58    64    65   3.62500 -1.0 2.0
   59    58    64    66   3.62500 -1.0 2.0
   64    66    67    68   3.62500 -1.0 2.0
   64    66    67    71   3.62500 -1.0 2.0
   64    66    69    70   0.84100 -1.0 2.0
   65    64    66    67   3.62500 -1.0 2.0
   65    64    66    69   3.62500 -1.0 2.0
   66    67   -71    55   3.62500 -1.0 2.0
   66    67    71    72   3.62500 -1.0 2.0
   67    66    69    70   0.84100 -1.0 2.0
   68    67    71    55   3.62500 -1.0 2.0
   68    67    71    72   3.62500 -1.0 2.0
   71    55    58    59   3.62500 -1.0 2.0
   71    55   -58    64   3.62500 -1.0 2.0
   69    66    67    68   3.62500 -1.0 2.0
   69    66    67    71   3.62500 -1.0 2.0
   40    33    38    39   0.00000  1.0 1.0
   40    33    38    41   0.42700  1.0 1.0
   40    33    38    41  -0.70350 -1.0 2.0
   40    33    38    41  -0.43150  1.0 3.0
   40    43    48    49   0.15000  1.0 3.0
   40    43    48    50   0.15000  1.0 3.0
   40    43    48    53   0.56750  1.0 1.0
   40    43    48    53  -0.07550 -1.0 2.0
   40    43    48    53   0.20000  1.0 3.0
   43    48    53    54   0.00000  1.0 1.0
   43    48    53    56  -0.43950  1.0 1.0
   43    48    53    56  -0.08100 -1.0 2.0
   43    48    53    56   0.03350  1.0 3.0
   44    43    48    49   0.15000  1.0 3.0
   44    43    48    50   0.15000  1.0 3.0
   44    43    48    53   0.15000  1.0 3.0
   45    43    48    49   0.15000  1.0 3.0
   45    43    48    50   0.15000  1.0 3.0
   45    43    48    53   0.15000  1.0 3.0
   48    53    56    57   3.04450 -1.0 2.0
   48    53    56    60   1.49850  1.0 1.0
   48    53    56    60   1.53950 -1.0 2.0
   49    48    53    54   0.00000  1.0 1.0
   49    48    53    56   0.00000  1.0 1.0
   50    48    53    54   0.00000  1.0 1.0
   50    48    53    56   0.00000  1.0 1.0
   53    56    60    61   0.00000  1.0 1.0
   53    56    60    62   0.00000  1.0 1.0
   53    56    60    63   0.00000  1.0 1.0
   54    53    56    57   2.45000 -1.0 2.0
   54    53    56    60   2.45000 -1.0 2.0
   57    56    60    61   0.00000  1.0 1.0
   57    56    60    62   0.00000  1.0 1.0
   57    56    60    63   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    41  15.00000 -1.0 2.0
   46    42    41    38  15.00000 -1.0 2.0
   41    47    46    51  15.00000 -1.0 2.0
   55    52    51    46  15.00000 -1.0 2.0
   58    71    55    51   4.00000 -1.0 2.0
   64    59    58    55   1.10000 -1.0 2.0
   66    65    64    58   1.10000 -1.0 2.0
   67    69    66    64   4.00000 -1.0 2.0
   71    68    67    66   1.10000 -1.0 2.0
   67    72    71    55   1.10000 -1.0 2.0
   54    56    53    48   1.00000 -1.0 2.0
   53    60    56    57  10.50000 -1.0 2.0
END
