* LIGAND DATABASE FILE (OPLS2005)
*
001      76    76    135    193     387
    1     0 S   NP   _N1_     1    28.69972    96.18053   -25.06071
    2     1 S   H    _HN1     2     1.02833    31.62853   163.78639
    3     1 S   H    _H1_     3     1.02782   116.61640  -115.36137
    4     1 S   H    _H2_     4     1.02951    75.54639   -11.79171
    5     1 S   CT   _CA1     5     1.50122   125.59855    93.19140
    6     5 S   HC   _HA1     6     1.09573   105.19623    91.19591
    7     5 S   CO3  _C1_     7     1.53792   112.35410   -29.03499
    8     7 S   O2Z  _O11     8     1.26376   115.00191   -44.19145
    9     7 S   O2Z  _O12     9     1.26228   114.94669   134.82490
   10     5 S   CT   _CB1    10     1.53077   107.41980  -150.83641
   11    10 S   HC   HB11    11     1.09833   109.40873   -49.51949
   12    10 S   HC   HB12    12     1.09811   110.45075    67.09325
   13    10 S   CT   _CG1    13     1.52994   112.58643  -170.47181
   14    13 S   HC   HG11    14     1.09582   110.63814   -65.11300
   15    13 S   HC   HG12    15     1.09672   109.80301    54.10924
   16    13 S   C    _CD1    16     1.51797   112.17928   174.58792
   17    16 S   O    _OE1    17     1.22753   123.37280     7.30584
   18    16 S   N    _N2_    18     1.38574   111.75121  -172.73480
   19    18 S   H    _HN2    19     1.01628   119.21293    -0.14537
   20    18 S   CT1  _CA2    20     1.46047   122.73453   178.70941
   21    20 S   HC   _HA2    21     1.09751   108.38614    32.57840
   22    20 S   C    _C2_    22     1.53257   110.53618   -83.83902
   23    22 S   O    _O2_    23     1.23159   120.92758   161.52826
   24    20 S   CT   _CB2    32     1.53337   111.52376   155.20311
   25    24 S   HC   HB21    33     1.09482   109.73605    54.41658
   26    24 S   HC   HB22    34     1.09464   109.80059   173.15719
   27    22 S   N    _N3_    24     1.38047   114.79082   -24.80432
   28    27 S   H    _HN3    25     1.01589   119.45029     5.32517
   29    24 S   S    _SG2    35     1.83268   110.61000   -67.38819
   30    27 S   CT   _CA3    26     1.45260   123.07927  -177.70672
   31    30 S   HC   HA31    27     1.09547   107.86084   -57.28063
   32    30 S   HC   HA32    28     1.09545   107.65668    59.04525
   33    29 S   CT   _C16    36     1.88264   101.92954   165.54226
   34    33 S   OM   _O34    37     1.31522   108.76834   -63.62725
   35    30 S   CO3  _C3_    29     1.52870   113.97654  -178.66881
   36    35 S   O2Z  _O31    30     1.26376   115.93456    14.79883
   37    35 S   O2Z  _O32    31     1.26398   114.52371  -165.30618
   38    33 S   CT   _C15    38     1.58214   110.57912    58.22842
   39    38 S   HC   _H4_    39     1.09873   109.95882   -58.07987
   40    33 S   S    _S1_    72     1.87937   106.81771   177.68244
   41    38 S   CT   _C14    40     1.58957   118.97261   175.14837
   42    41 S   OM   _O35    41     1.33051   108.64783  -174.15990
   43    41 S   HC   _H3_    42     1.09848   105.36926   -47.12143
   44    38 S   NP   _N4_    68     1.51816   107.29747    54.60227
   45    44 S   H    _H18    69     1.02861   109.33537   179.01643
   46    44 S   H    _H19    70     1.02736   110.26164    60.49370
   47    44 S   H    _H20    71     1.02652   111.46323   -60.15122
   48    40 S   CT   _C17    73     1.81744   102.36854    67.84915
   49    48 S   HC   _H15    74     1.09388   108.27563  -177.47044
   50    48 S   HC   _H16    75     1.09283   111.18713    64.40950
   51    48 S   HC   _H17    76     1.09212   111.61064   -59.00357
   52    41 S   CA   _C10    43     1.53370   113.27949    67.95667
   53    52 S   CA   _C11    44     1.40495   119.37874  -130.34152
   54    53 S   HA   _H12    45     1.08733   120.21275    -0.73966
   55    53 S   CA   _C12    46     1.39553   120.88614   178.53593
   56    55 S   HA   _H13    47     1.08615   119.16478  -179.29807
   57    55 S   CA   _C13    48     1.39502   119.91056     0.12195
   58    57 S   CA   _C8_    49     1.39888   120.93835     0.89918
   59    57 S   OH   _O33    66     1.36904   119.72966  -178.86910
   60    59 S   HO   _H14    67     0.97212   108.63953     0.44762
   61    52 S   CA   _C9_    50     1.40907   122.51234    49.42813
   62    61 S   HA   _H11    51     1.08784   119.51570     0.88735
   63    58 S   CT   _C7_    52     1.51047   122.39651  -178.26089
   64    63 S   HC   _H9_    53     1.09478   109.06672  -139.75307
   65    63 S   HC   _H10    54     1.09699   110.37401   -25.80608
   66    63 S   CM   _C6_    55     1.50419   111.88011    95.10839
   67    66 S   HC   _H8_    56     1.08988   113.99656   -72.76019
   68    66 S   CM   _C5_    57     1.34708   128.03288   107.43448
   69    68 S   CT   _C4_    58     1.50571   120.36529  -179.81977
   70    69 S   HC   _H5_    59     1.09488   110.23206   119.59909
   71    69 S   HC   _H6_    60     1.09469   110.19655  -120.43977
   72    69 S   HC   _H7_    61     1.09507   112.43048    -0.41543
   73    68 S   CT   _C18    62     1.50239   125.36478    -0.64346
   74    73 S   HC   _H21    63     1.09503   110.06523   120.51838
   75    73 S   HC   _H22    64     1.09448   110.02396  -120.15966
   76    73 S   HC   _H23    65     1.09148   113.74935    -0.08623
  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
  16   6   2   1   1  13   9   6  13   5   4   4   2   1   1   3
   2   1   1   9   8   4   7   3   9  10   3   1   5   1   7   4
   3  10   3   8   7   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    44    40    48  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    43    52    44    45    46    47    40    48    49    50    51  
   38    39    41    44    40    48  
   36    37  
   37  
    0  
   39    41    42    43    52    53    61    44    45    46    47    40    48  
   41    42    43    52    44    45    46    47    40  
   48    49    50    51    41    44  
   42    43    52    53    54    55    58    61    62    44    45    46    47  
   43    52    53    61    44  
   52    53    61    44  
   45    46    47    52  
   46    47  
   47  
    0  
   49    50    51  
   50    51  
   51  
    0  
   53    54    55    56    57    58    61    62    63  
   54    55    56    57    58    61    62    59  
   55    56    57    61  
   56    57    58    61    63    59    60  
   57    58    59  
   58    61    62    63    64    65    66    59    60  
   61    62    63    64    65    66    67    68    59    60  
   60    61    63  
    0  
   62    63    64    65    66  
   63  
   64    65    66    67    68    69    73  
   65    66    67    68  
   66    67    68  
   67    68    69    70    71    72    73    74    75    76  
   68    69    73  
   69    70    71    72    73    74    75    76  
   70    71    72    73    74    75    76  
   71    72    73  
   72    73  
   73  
   74    75    76  
   75    76  
   76  
    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   3.5000   0.0660   0.250000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   40   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   41   4.2000   0.3000   0.035000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   43   2.5000   0.0500   0.060000   1.6450   1.4500   0.008598240   0.268726247
   44   3.2500   0.1700  -0.300000   2.1950   1.9500   0.003973653   1.685851020
   45   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   46   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   47   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5000   0.0660  -0.012500   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   58   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   67   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   570.000  1.307
   33    38   268.000  1.529
   33    40   222.000  1.810
   38    39   340.000  1.090
   38    41   268.000  1.529
   38    44   367.000  1.471
   41    42   570.000  1.307
   41    43   340.000  1.090
   41    52   317.000  1.510
   52    53   469.000  1.400
   52    61   469.000  1.400
   53    54   367.000  1.080
   53    55   469.000  1.400
   55    56   367.000  1.080
   55    57   469.000  1.400
   57    58   469.000  1.400
   57    59   450.000  1.364
   58    61   469.000  1.400
   58    63   317.000  1.510
   61    62   367.000  1.080
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   317.000  1.510
   66    67   340.000  1.080
   66    68   549.000  1.340
   68    69   317.000  1.510
   68    73   317.000  1.510
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   59    60   553.000  0.945
   44    45   434.000  1.010
   44    46   434.000  1.010
   44    47   434.000  1.010
   40    48   222.000  1.810
   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    85.00000  114.68000
   29    33    38    75.00000  111.63000
   29    33    40    75.00000  118.28000
   33    38    39    37.50000  110.70000
   33    38    41    58.35000  112.70000
   33    38    44    80.00000  111.20000
   33    40    48    62.00000   98.90000
   38    33    34    50.00000  109.50000
   38    41    42    50.00000  109.50000
   38    41    43    37.50000  110.70000
   38    41    52    70.00000  112.17500
   38    44    45    35.00000  109.50000
   38    44    46    35.00000  109.50000
   38    44    47    35.00000  109.50000
   41    38    39    37.50000  110.70000
   41    52    53    70.00000  120.00000
   41    52    61    70.00000  120.00000
   43    41    42    45.00000  125.66300
   52    41    42    85.00000  111.85700
   52    41    43    35.00000  109.50000
   52    53    54    35.00000  120.00000
   52    53    55    63.00000  120.00000
   52    61    58    63.00000  120.00000
   52    61    62    35.00000  120.00000
   53    55    56    35.00000  120.00000
   53    55    57    63.00000  120.00000
   55    53    54    35.00000  120.00000
   55    57    58    63.00000  120.00000
   55    57    59    70.00000  120.00000
   57    55    56    35.00000  120.00000
   57    58    61    63.00000  120.00000
   57    58    63    70.00000  120.00000
   57    59    60    35.00000  113.00000
   58    61    62    35.00000  120.00000
   58    63    64    35.00000  109.50000
   58    63    65    35.00000  109.50000
   58    63    66    70.00000  112.99600
   61    52    53    63.00000  120.00000
   63    58    61    70.00000  120.00000
   63    66    67    35.00000  117.00000
   63    66    68    70.00000  124.00000
   65    63    64    33.00000  107.80000
   66    63    64    35.00000  109.50000
   66    63    65    35.00000  109.50000
   66    68    69    70.00000  124.00000
   66    68    73    70.00000  124.00000
   68    66    67    35.00000  120.00000
   68    69    70    35.00000  109.50000
   68    69    71    35.00000  109.50000
   68    69    72    35.00000  109.50000
   68    73    74    35.00000  109.50000
   68    73    75    35.00000  109.50000
   68    73    76    35.00000  109.50000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   73    68    69    65.00000  117.92700
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   59    57    58    70.00000  120.00000
   44    38    39    35.00000  109.50000
   44    38    41    80.00000  111.20000
   46    44    45    35.00000  109.50000
   47    44    45    35.00000  109.50000
   47    44    46    35.00000  109.50000
   40    33    34    85.00000  114.68000
   40    33    38    75.00000  111.63000
   40    48    49    35.00000  109.50000
   40    48    50    35.00000  109.50000
   40    48    51    35.00000  109.50000
   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   0.13850  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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  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   0.15000  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    38    44   0.56750  1.0 1.0
   29    33    38    44  -0.07550 -1.0 2.0
   29    33    38    44   0.20000  1.0 3.0
   29    33    40    48   0.08500  1.0 1.0
   29    33    40    48  -0.53150 -1.0 2.0
   29    33    40    48   0.48050  1.0 3.0
   33    38    41    42   0.62750  1.0 1.0
   33    38    41    42  -0.30950 -1.0 2.0
   33    38    41    42   0.27300  1.0 3.0
   33    38    41    43   0.15000  1.0 3.0
   33    38    41    52  -0.03700  1.0 1.0
   33    38    41    52   0.37200 -1.0 2.0
   33    38    41    52  -0.47300  1.0 3.0
   33    38    44    45   0.17350  1.0 3.0
   33    38    44    46   0.17350  1.0 3.0
   33    38    44    47   0.17350  1.0 3.0
   33    40    48    49   0.32350  1.0 3.0
   33    40    48    50   0.32350  1.0 3.0
   33    40    48    51   0.32350  1.0 3.0
   34    33    38    39   0.23400  1.0 3.0
   34    33    38    41   0.62750  1.0 1.0
   34    33    38    41  -0.30950 -1.0 2.0
   34    33    38    41   0.27300  1.0 3.0
   34    33    38    44   1.69300  1.0 1.0
   34    33    38    44  -0.48450 -1.0 2.0
   34    33    40    48   0.13850  1.0 1.0
   34    33    40    48  -1.34450 -1.0 2.0
   34    33    40    48   0.57400  1.0 3.0
   38    33    40    48   0.01700  1.0 1.0
   38    33    40    48  -0.23550 -1.0 2.0
   38    33    40    48   0.21350  1.0 3.0
   38    41    52    53   0.04150 -1.0 2.0
   38    41    52    61   0.04150 -1.0 2.0
   39    38    41    42   0.23400  1.0 3.0
   39    38    41    43   0.15000  1.0 3.0
   39    38    41    52   0.43200  1.0 3.0
   39    38    44    45   0.13050  1.0 3.0
   39    38    44    46   0.13050  1.0 3.0
   39    38    44    47   0.13050  1.0 3.0
   41    38    44    45   0.17350  1.0 3.0
   41    38    44    46   0.17350  1.0 3.0
   41    38    44    47   0.17350  1.0 3.0
   41    52    53    54   3.62500 -1.0 2.0
   41    52    53    55   3.62500 -1.0 2.0
   41    52    61    58   3.62500 -1.0 2.0
   41    52    61    62   3.62500 -1.0 2.0
   42    41    52    53   0.64500  1.0 1.0
   42    41    52    53   0.14800 -1.0 2.0
   42    41    52    53   0.20650  1.0 3.0
   42    41    52    61   0.64500  1.0 1.0
   42    41    52    61   0.14800 -1.0 2.0
   42    41    52    61   0.20650  1.0 3.0
   43    41    52    53   0.00000  1.0 1.0
   43    41    52    61   0.00000  1.0 1.0
   52    53    55    56   3.62500 -1.0 2.0
   52    53    55    57   3.62500 -1.0 2.0
   53    52    61    58   3.62500 -1.0 2.0
   53    52    61    62   3.62500 -1.0 2.0
   53    55   -57    58   3.62500 -1.0 2.0
   53    55    57    59   3.62500 -1.0 2.0
   54    53    55    56   3.62500 -1.0 2.0
   54    53    55    57   3.62500 -1.0 2.0
   55    57    58    61   3.62500 -1.0 2.0
   55    57    58    63   3.62500 -1.0 2.0
   55    57    59    60   0.84100 -1.0 2.0
   56    55    57    58   3.62500 -1.0 2.0
   56    55    57    59   3.62500 -1.0 2.0
   57    58   -61    52   3.62500 -1.0 2.0
   57    58    61    62   3.62500 -1.0 2.0
   57    58    63    64   0.00000  1.0 1.0
   57    58    63    65   0.00000  1.0 1.0
   57    58    63    66   0.18050 -1.0 2.0
   58    57    59    60   0.84100 -1.0 2.0
   58    63    66    67   0.00000  1.0 1.0
   58    63    66    68   1.44450  1.0 1.0
   58    63    66    68   0.06600 -1.0 2.0
   58    63    66    68   0.29250  1.0 3.0
   61    52    53    54   3.62500 -1.0 2.0
   61    52   -53    55   3.62500 -1.0 2.0
   61    58    63    64   0.00000  1.0 1.0
   61    58    63    65   0.00000  1.0 1.0
   61    58    63    66   0.18050 -1.0 2.0
   63    58    61    52   3.62500 -1.0 2.0
   63    58    61    62   3.62500 -1.0 2.0
   63    66    68    69   7.00000 -1.0 2.0
   63    66    68    73   7.00000 -1.0 2.0
   64    63    66    67   0.33100  1.0 3.0
   64    63    66    68   0.00000  1.0 1.0
   65    63    66    67   0.33100  1.0 3.0
   65    63    66    68   0.00000  1.0 1.0
   66    68    69    70   0.00000  1.0 1.0
   66    68    69    71   0.00000  1.0 1.0
   66    68    69    72   0.00000  1.0 1.0
   66    68    73    74   0.00000  1.0 1.0
   66    68    73    75   0.00000  1.0 1.0
   66    68    73    76   0.00000  1.0 1.0
   67    66    68    69   7.00000 -1.0 2.0
   67    66    68    73   7.00000 -1.0 2.0
   69    68    73    74   0.34800  1.0 3.0
   69    68    73    75   0.34800  1.0 3.0
   69    68    73    76   0.34800  1.0 3.0
   73    68    69    70   0.34800  1.0 3.0
   73    68    69    71   0.34800  1.0 3.0
   73    68    69    72   0.34800  1.0 3.0
   59    57    58    61   3.62500 -1.0 2.0
   59    57    58    63   3.62500 -1.0 2.0
   44    38    41    42   1.69300  1.0 1.0
   44    38    41    42  -0.48450 -1.0 2.0
   44    38    41    43   0.19200  1.0 3.0
   44    38    41    52   1.24050  1.0 1.0
   44    38    41    52   0.48100 -1.0 2.0
   44    38    41    52   1.08150  1.0 3.0
   40    33    38    39   0.15000  1.0 3.0
   40    33    38    41   0.44750  1.0 1.0
   40    33    38    41  -0.17800 -1.0 2.0
   40    33    38    41   0.20200  1.0 3.0
   40    33    38    44   0.56750  1.0 1.0
   40    33    38    44  -0.07550 -1.0 2.0
   40    33    38    44   0.20000  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
   53    61    52    41   4.00000 -1.0 2.0
   55    54    53    52   1.10000 -1.0 2.0
   57    56    55    53   1.10000 -1.0 2.0
   58    59    57    55   4.00000 -1.0 2.0
   61    63    58    57   4.00000 -1.0 2.0
   58    62    61    52   1.10000 -1.0 2.0
   63    67    66    68  15.00000 -1.0 2.0
   69    73    68    66  15.00000 -1.0 2.0
END
