* LIGAND DATABASE FILE (OPLS2005)
*
001      67    68    119    187     351
    1     0 S   NP   _N1_     1    28.15472    96.08187   -23.45998
    2     1 S   H    _HN1     2     1.02957    78.10901     1.06441
    3     1 S   H    _H1_     3     1.02836    31.10868   159.36550
    4     1 S   H    _H2_     4     1.02777   107.38204  -104.65343
    5     1 S   CT   _CA1     5     1.50132   133.41146   107.98370
    6     5 S   HC   _HA1     6     1.09575   105.21170    84.77173
    7     5 S   CO3  _C1_     7     1.53777   112.33448   -35.41096
    8     7 S   O2Z  _O11     8     1.26365   114.99782   -44.52319
    9     7 S   O2Z  _O12     9     1.26231   114.92407   134.52819
   10     5 S   CT   _CB1    10     1.53090   107.41709  -157.33901
   11    10 S   HC   HB11    11     1.09829   109.31172   -50.54590
   12    10 S   HC   HB12    12     1.09816   110.43745    65.99581
   13    10 S   CT   _CG1    13     1.53030   112.69156  -171.61260
   14    13 S   HC   HG11    14     1.09593   110.51059   -64.70356
   15    13 S   HC   HG12    15     1.09657   109.91028    54.51271
   16    13 S   C    _CD1    16     1.51843   112.26317   174.86569
   17    16 S   O    _OE1    17     1.22762   123.27654     1.24835
   18    16 S   N    _N2_    18     1.38564   111.77666  -178.79212
   19    18 S   H    _HN2    19     1.01572   119.05781     4.31257
   20    18 S   CT1  _CA2    20     1.45781   122.79082   177.59629
   21    20 S   HC   _HA2    21     1.09737   108.92581    23.53073
   22    20 S   C    _C2_    22     1.52897   106.99540   -93.52453
   23    22 S   O    _O2_    23     1.22985   122.92514   -29.50113
   24    20 S   CT   _CB2    32     1.53082   112.28556   146.60791
   25    24 S   HC   HB21    33     1.09560   110.67571    53.53191
   26    24 S   HC   HB22    34     1.09490   109.72203   172.42594
   27    22 S   N    _N3_    24     1.38556   112.68694   153.17075
   28    27 S   H    _HN3    25     1.01602   120.36223    -1.47140
   29    24 S   S    _SG2    35     1.82693   111.01429   -67.37729
   30    27 S   CT   _CA3    26     1.45377   122.31501   178.87830
   31    30 S   HC   HA31    27     1.09566   107.61020   -60.35624
   32    30 S   HC   HA32    28     1.09575   107.71238    55.87005
   33    29 S   CT   _C15    36     1.83737    99.34409  -169.18131
   34    33 S   HC   _H3_    37     1.09294   109.60932    26.78245
   35    30 S   CO3  _C3_    29     1.52863   114.60419   177.96068
   36    35 S   O2Z  _O31    30     1.26413   114.43514  -175.79788
   37    35 S   O2Z  _O32    31     1.26375   116.17943     4.44250
   38    33 S   CM   _C11    38     1.50292   107.31963   -87.85787
   39    38 S   HC   _H25    39     1.09147   114.90903    66.36491
   40    38 S   CMA  _C12    40     1.34612   127.94864  -114.30607
   41    40 S   OM   _O16    41     1.26197   129.33296   179.90513
   42    40 S   CO4  _C14    42     1.51018   114.81459     0.10468
   43    42 S   O    _O17    43     1.23125   122.78982   173.00120
   44    42 S   CM   _C10    44     1.48392   119.09497    -8.44069
   45    44 S   HC   _H24    45     1.08419   114.19041  -172.48629
   46    33 S   CM   _C13    46     1.52106   110.46520   147.02337
   47    46 S   CT   _C18    47     1.56667   120.41635   -69.23026
   48    47 S   CA   _C8_    48     1.54837   112.54975   -23.28161
   49    47 S   CT   _C16    60     1.55305   107.86785   102.00604
   50    49 S   HC   _H27    61     1.09708   111.38436    58.85147
   51    49 S   HC   _H28    62     1.09379   112.93729   -61.08168
   52    49 S   HC   _H29    63     1.09708   111.22891   178.06477
   53    47 S   CT   _C17    64     1.56092   111.85903  -143.19307
   54    53 S   HC   _H30    65     1.09620   112.21729   -69.98834
   55    53 S   HC   _H31    66     1.09601   112.21359    50.56139
   56    53 S   HC   _H32    67     1.09756   111.10595   170.99174
   57    48 S   CA   _C4_    49     1.40713   122.53084   110.04229
   58    57 S   HA   _H20    50     1.08595   121.49046     1.25492
   59    57 S   CA   _C6_    51     1.39808   121.32759  -177.70723
   60    59 S   HA   _H22    52     1.08630   119.37848   179.50071
   61    59 S   CA   _C9_    53     1.38953   119.75938    -0.17471
   62    61 S   CA   _C7_    54     1.38796   120.49706    -0.82448
   63    62 S   HA   _H23    55     1.08615   120.53878   179.94065
   64    61 S   OH   _O18    58     1.36536   121.14811   178.71154
   65    64 S   HO   _H33    59     0.97703   108.58491   -11.21990
   66    48 S   CA   _C5_    56     1.41171   120.12069   -68.55430
   67    66 S   HA   _H21    57     1.08750   120.53163    -0.33102
  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
  13   6   2   1   1   8   4   6   3   5   3   6   2  12  15  17
   9   3   2   1   5   2   1   1   8   4   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    46    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    46    47  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    44    45    46    47    48    49    53  
   38    39    40    44    46    47  
   36    37  
   37  
    0  
   39    40    41    42    43    44    46    47  
   40    41    42    46  
   41    42    43    44    45    46  
   42    43    44  
   43    44    45    46    47  
   44    45    46  
   45    46    47    48    49    53  
   46    47  
   47    48    57    66    49    50    51    52    53    54    55    56  
   48    57    58    59    62    66    67    49    50    51    52    53    54    55    56  
   57    58    59    60    61    62    63    66    67    49    50    51    52    53    54    55    56  
   50    51    52    53    54    55    56    57    66  
   51    52    53  
   52    53  
   53  
   54    55    56    57    66  
   55    56  
   56  
    0  
   58    59    60    61    62    66    67    64  
   59    60    61    66  
   60    61    62    63    66    64    65  
   61    62    64  
   62    63    66    67    64    65  
   63    66    67    64    65  
   66    67    64  
   65    66  
    0  
   67  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   47   3.5000   0.0660   0.115000   1.9750   1.7500   0.005000000  -0.741685710
   48   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   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   340.000  1.090
   33    38   317.000  1.510
   33    46   317.000  1.510
   38    39   340.000  1.080
   38    40   465.000  1.376
   40    41   745.000  1.250
   40    42   270.000  1.476
   42    43   570.000  1.229
   42    44   320.000  1.462
   44    45   340.000  1.080
   44    46   549.000  1.340
   46    47   317.000  1.510
   47    48   317.000  1.510
   47    49   268.000  1.529
   47    53   268.000  1.529
   48    57   469.000  1.400
   48    66   469.000  1.400
   57    58   367.000  1.080
   57    59   469.000  1.400
   59    60   367.000  1.080
   59    61   469.000  1.400
   61    62   469.000  1.400
   61    64   450.000  1.364
   62    63   367.000  1.080
   62    66   469.000  1.400
   66    67   367.000  1.080
   64    65   553.000  0.945
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    46    75.00000  112.20000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    46    44    70.00000  124.00000
   33    46    47    65.00000  117.92700
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  137.10300
   38    40    42    65.00000  114.61000
   40    38    39    40.00000  120.50800
   40    42    43    80.00000  120.81000
   40    42    44    65.00000  118.65900
   42    40    41    85.00000  116.28000
   42    44    45    40.00000  117.72500
   42    44    46    65.00000  118.96000
   44    42    43    80.00000  123.72100
   44    46    47    70.00000  124.00000
   46    33    34    35.00000  109.50000
   46    33    38    70.00000  110.12100
   46    44    45    35.00000  120.00000
   46    47    48    70.00000  112.99600
   46    47    49    70.00000  112.02700
   46    47    53    70.00000  112.02700
   47    48    57    70.00000  120.00000
   47    48    66    70.00000  120.00000
   47    49    50    37.50000  110.70000
   47    49    51    37.50000  110.70000
   47    49    52    37.50000  110.70000
   47    53    54    37.50000  110.70000
   47    53    55    37.50000  110.70000
   47    53    56    37.50000  110.70000
   48    57    58    35.00000  120.00000
   48    57    59    63.00000  120.00000
   48    66    62    63.00000  120.00000
   48    66    67    35.00000  120.00000
   57    59    60    35.00000  120.00000
   57    59    61    63.00000  120.00000
   59    57    58    35.00000  120.00000
   59    61    62    63.00000  120.00000
   59    61    64    70.00000  120.00000
   61    59    60    35.00000  120.00000
   61    62    63    35.00000  120.00000
   61    62    66    63.00000  120.00000
   61    64    65    35.00000  113.00000
   62    66    67    35.00000  120.00000
   66    48    57    63.00000  120.00000
   66    62    63    35.00000  120.00000
   64    61    62    70.00000  120.00000
   49    47    48    70.00000  112.17500
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   53    47    48    70.00000  112.17500
   53    47    49    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    46  -0.62250  1.0 1.0
   24    29    33    46  -0.38450 -1.0 2.0
   24    29    33    46   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    46    44   0.42700  1.0 1.0
   29    33    46    44  -0.70350 -1.0 2.0
   29    33    46    44  -0.43150  1.0 3.0
   29    33    46    47   0.30250  1.0 1.0
   29    33    46    47  -0.14950 -1.0 2.0
   29    33    46    47   0.36900  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    42   7.00000 -1.0 2.0
   33    46    47    48   0.09700  1.0 1.0
   33    46    47    48   0.15600 -1.0 2.0
   33    46    47    48  -0.50800  1.0 3.0
   33    46    47    49   0.46850  1.0 1.0
   33    46    47    49   0.08550 -1.0 2.0
   33    46    47    49   0.09800  1.0 3.0
   33    46    47    53   0.46850  1.0 1.0
   33    46    47    53   0.08550 -1.0 2.0
   33    46    47    53   0.09800  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    46    44   0.00000  1.0 1.0
   34    33    46    47   0.34800  1.0 3.0
   38    33    46    44  -0.28300  1.0 1.0
   38    33    46    44   0.26700 -1.0 2.0
   38    33    46    44  -0.63300  1.0 3.0
   38    33    46    47   0.09700  1.0 1.0
   38    33    46    47   0.15600 -1.0 2.0
   38    33    46    47  -0.50800  1.0 3.0
   38    40    42    43   1.00000 -1.0 2.0
   38    40   -42    44  -1.18350  1.0 1.0
   38    40   -42    44   1.45950 -1.0 2.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42    44    45   0.93700 -1.0 2.0
   40    42    44    46  -1.18350  1.0 1.0
   40    42    44    46   1.45950 -1.0 2.0
   41    40    42    43  -0.11900  1.0 1.0
   41    40    42    43   0.76850 -1.0 2.0
   41    40    42    43   0.14100  1.0 3.0
   41    40    42    44   1.50000 -1.0 2.0
   42    44   -46    33   7.00000 -1.0 2.0
   42    44    46    47   7.00000 -1.0 2.0
   43    42    44    45   0.00000  1.0 1.0
   43    42    44    46   1.00000 -1.0 2.0
   44    46    47    48   1.44450  1.0 1.0
   44    46    47    48   0.06600 -1.0 2.0
   44    46    47    48   0.29250  1.0 3.0
   44    46    47    49   0.09850  1.0 1.0
   44    46    47    49   0.15250 -1.0 2.0
   44    46    47    49  -0.50650  1.0 3.0
   44    46    47    53   0.09850  1.0 1.0
   44    46    47    53   0.15250 -1.0 2.0
   44    46    47    53  -0.50650  1.0 3.0
   45    44    46    33   7.00000 -1.0 2.0
   45    44    46    47   7.00000 -1.0 2.0
   46    33    38    39   0.00000  1.0 1.0
   46    33   -38    40  -0.28300  1.0 1.0
   46    33   -38    40   0.26700 -1.0 2.0
   46    33   -38    40  -0.63300  1.0 3.0
   46    47    48    57   0.18050 -1.0 2.0
   46    47    48    66   0.18050 -1.0 2.0
   46    47    49    50   0.15000  1.0 3.0
   46    47    49    51   0.15000  1.0 3.0
   46    47    49    52   0.15000  1.0 3.0
   46    47    53    54   0.15000  1.0 3.0
   46    47    53    55   0.15000  1.0 3.0
   46    47    53    56   0.15000  1.0 3.0
   47    48    57    58   3.62500 -1.0 2.0
   47    48    57    59   3.62500 -1.0 2.0
   47    48    66    62   3.62500 -1.0 2.0
   47    48    66    67   3.62500 -1.0 2.0
   48    47    49    50   0.43200  1.0 3.0
   48    47    49    51   0.43200  1.0 3.0
   48    47    49    52   0.43200  1.0 3.0
   48    47    53    54   0.43200  1.0 3.0
   48    47    53    55   0.43200  1.0 3.0
   48    47    53    56   0.43200  1.0 3.0
   48    57    59    60   3.62500 -1.0 2.0
   48    57    59    61   3.62500 -1.0 2.0
   57    48    66    62   3.62500 -1.0 2.0
   57    48    66    67   3.62500 -1.0 2.0
   57    59   -61    62   3.62500 -1.0 2.0
   57    59    61    64   3.62500 -1.0 2.0
   58    57    59    60   3.62500 -1.0 2.0
   58    57    59    61   3.62500 -1.0 2.0
   59    61    62    63   3.62500 -1.0 2.0
   59    61    62    66   3.62500 -1.0 2.0
   59    61    64    65   0.84100 -1.0 2.0
   60    59    61    62   3.62500 -1.0 2.0
   60    59    61    64   3.62500 -1.0 2.0
   61    62   -66    48   3.62500 -1.0 2.0
   61    62    66    67   3.62500 -1.0 2.0
   62    61    64    65   0.84100 -1.0 2.0
   63    62    66    48   3.62500 -1.0 2.0
   63    62    66    67   3.62500 -1.0 2.0
   66    48    57    58   3.62500 -1.0 2.0
   66    48   -57    59   3.62500 -1.0 2.0
   64    61    62    63   3.62500 -1.0 2.0
   64    61    62    66   3.62500 -1.0 2.0
   49    47    48    57   0.04150 -1.0 2.0
   49    47    48    66   0.04150 -1.0 2.0
   49    47    53    54   0.15000  1.0 3.0
   49    47    53    55   0.15000  1.0 3.0
   49    47    53    56   0.15000  1.0 3.0
   53    47    48    57   0.04150 -1.0 2.0
   53    47    48    66   0.04150 -1.0 2.0
   53    47    49    50   0.15000  1.0 3.0
   53    47    49    51   0.15000  1.0 3.0
   53    47    49    52   0.15000  1.0 3.0
IPHI
    9     5     7     8  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
   37    30    35    36  10.50000 -1.0 2.0
   33    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   40    44    42    43  10.50000 -1.0 2.0
   42    45    44    46   1.10000 -1.0 2.0
   33    47    46    44   1.10000 -1.0 2.0
   57    66    48    47   4.00000 -1.0 2.0
   59    58    57    48   1.10000 -1.0 2.0
   61    60    59    57   1.10000 -1.0 2.0
   62    64    61    59   4.00000 -1.0 2.0
   66    63    62    61   1.10000 -1.0 2.0
   62    67    66    48   1.10000 -1.0 2.0
END
