* LIGAND DATABASE FILE (OPLS2005)
*
001      72    72    123    183     357
    1     0 S   NP   _N1_     1    29.28087    98.63463   -23.42307
    2     1 S   H    _HN1     2     1.02797   112.36751   -99.83150
    3     1 S   H    _H1_     3     1.02951    58.83095    -1.27349
    4     1 S   H    _H2_     4     1.02826    49.31801   165.34886
    5     1 S   CT   _CA1     5     1.50133   135.17196    86.98107
    6     5 S   HC   _HA1     6     1.09574   105.19835   112.03497
    7     5 S   CO3  _C1_     7     1.53769   112.34239    -8.27906
    8     7 S   O2Z  _O11     8     1.26379   115.00991   -43.80449
    9     7 S   O2Z  _O12     9     1.26191   114.94797   135.08255
   10     5 S   CT   _CB1    10     1.53041   107.38681  -129.87418
   11    10 S   HC   HB11    11     1.09846   109.48598   -47.90447
   12    10 S   HC   HB12    12     1.09807   110.43839    68.71707
   13    10 S   CT   _CG1    13     1.53012   112.61879  -168.72366
   14    13 S   HC   HG11    14     1.09562   110.87780   -65.96285
   15    13 S   HC   HG12    15     1.09646   109.60243    53.28979
   16    13 S   C    _CD1    16     1.51831   111.73152   173.91453
   17    16 S   O    _OE1    17     1.22772   123.06827    17.12237
   18    16 S   N    _N2_    18     1.38537   111.93672  -163.18044
   19    18 S   H    _HN2    19     1.01537   119.23800     1.62726
   20    18 S   CT1  _CA2    20     1.46285   123.56853   177.59117
   21    20 S   HC   _HA2    21     1.09724   109.22133     9.60271
   22    20 S   C    _C2_    22     1.53767   109.57231  -106.17519
   23    22 S   O    _O2_    23     1.23111   122.06734  -156.31587
   24    20 S   CT   _CB2    32     1.53306   111.00867   131.57317
   25    24 S   HC   HB21    33     1.09411   109.22839    57.05179
   26    24 S   HC   HB22    34     1.09517   110.69170   175.28786
   27    22 S   N    _N3_    24     1.38253   114.17041    30.92341
   28    27 S   H    _HN3    25     1.01511   119.50118    -3.50476
   29    24 S   S    _SG2    35     1.83511   111.01650   -65.71774
   30    27 S   CT   _CA3    26     1.45240   123.41768   177.44587
   31    30 S   HC   HA31    27     1.09543   107.54995   -64.78391
   32    30 S   HC   HA32    28     1.09554   107.98599    51.70340
   33    29 S   CT   _C8_    36     1.87065   101.44820   145.58523
   34    33 S   OM   _O36    37     1.31283   109.75772    57.71379
   35    30 S   CO3  _C3_    29     1.52989   113.96666   173.71974
   36    35 S   O2Z  _O31    30     1.26398   116.09200     1.38169
   37    35 S   O2Z  _O32    31     1.26425   114.40978  -178.57839
   38    33 S   CM   _C9_    38     1.52640   107.27712   -69.56796
   39    38 S   HC   _H11    39     1.09454   111.68739   -60.27799
   40    33 S   S    _S1_    58     1.87184   105.86131   175.40633
   41    38 S   CMA  _C10    40     1.35774   132.43914   120.37009
   42    41 S   OM   _O35    41     1.26096   133.15318     0.97959
   43    40 S   CT   _C7_    59     1.83321   101.20680   176.29599
   44    43 S   HC   _H9_    60     1.09404   109.16276    59.84292
   45    43 S   HC   _H10    61     1.09400   109.59670   -59.37416
   46    41 S   CM   _C11    42     1.46943   117.69426   179.08059
   47    46 S   HC   _H12    43     1.08995   115.64702  -128.83655
   48    43 S   CT   _C6_    62     1.52777   110.56474   179.51221
   49    48 S   HC   _H7_    63     1.09556   111.46745   -55.05672
   50    48 S   HC   _H8_    64     1.09586   109.14583  -173.79224
   51    46 S   CM   _C12    44     1.34566   124.50012    52.86183
   52    51 S   HC   _H13    45     1.08668   119.56629     0.68927
   53    48 S   N    _N4_    65     1.45332   112.50137    65.95992
   54    53 S   H    _H6_    66     1.01515   117.48943   -88.01689
   55    51 S   CA   _C13    46     1.47156   125.01890   179.22924
   56    53 S   C    _C5_    67     1.38267   122.93758    88.33443
   57    56 S   O    _O33    68     1.22781   125.54710     1.15538
   58    55 S   CA   _C14    47     1.40292   122.72447    31.19800
   59    58 S   HA   _H14    48     1.08721   120.99732    -0.91322
   60    56 S   CT   _C4_    69     1.50468   112.43830  -177.81591
   61    60 S   HC   _H3_    70     1.09341   109.39234    74.52605
   62    60 S   HC   _H4_    71     1.09350   109.64615  -165.65044
   63    60 S   HC   _H5_    72     1.09379   110.44089   -46.01346
   64    58 S   CA   _C15    49     1.39711   120.63188   178.39746
   65    64 S   HA   _H15    50     1.08622   119.78740   179.88809
   66    64 S   CA   _C16    51     1.39079   119.71704    -0.58484
   67    66 S   CA   _C17    52     1.39146   120.65350    -0.11014
   68    67 S   HA   _H16    53     1.08580   121.05611  -179.46698
   69    66 S   OH   _O34    56     1.36608   118.24120  -179.83807
   70    69 S   HO   _H18    57     0.97232   108.49017   178.64044
   71    55 S   CA   _C18    54     1.40378   118.55574  -151.58390
   72    71 S   HA   _H17    55     1.08791   120.52207     1.62450
  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
