* LIGAND DATABASE FILE (OPLS2005)
*
001      72    73    132    206     381
    1     0 S   NP   _N1_     1    29.17891    95.54936   -19.00419
    2     1 S   H    _HN1     2     1.02964    92.83962    32.78728
    3     1 S   H    _H1_     3     1.02840    40.99350   145.66036
    4     1 S   H    _H2_     4     1.02780    76.67379   -75.40548
    5     1 S   CT   _CA1     5     1.50110   149.43505   173.15954
    6     5 S   HC   _HA1     6     1.09571   105.23837    40.19893
    7     5 S   CO3  _C1_     7     1.53773   112.53490   -80.02482
    8     7 S   O2Z  _O11     8     1.26336   114.98191   -40.31691
    9     7 S   O2Z  _O12     9     1.26239   114.97118   139.00636
   10     5 S   CT   _CB1    10     1.53099   107.45151   158.20335
   11    10 S   HC   HB11    11     1.09814   109.33568   -50.44345
   12    10 S   HC   HB12    12     1.09827   110.40959    66.15183
   13    10 S   CT   _CG1    13     1.52962   112.63581  -171.59744
   14    13 S   HC   HG11    14     1.09595   110.33087   -63.41904
   15    13 S   HC   HG12    15     1.09645   110.08685    55.73109
   16    13 S   C    _CD1    16     1.51796   112.40535   175.97134
   17    16 S   O    _OE1    17     1.22687   123.30205    -7.96657
   18    16 S   N    _N2_    18     1.38547   111.46687   172.61608
   19    18 S   H    _HN2    19     1.01583   118.93163     1.06146
   20    18 S   CT1  _CA2    20     1.46181   123.65459  -178.86737
   21    20 S   HC   _HA2    21     1.09729   109.45083   -13.53390
   22    20 S   C    _C2_    22     1.53461   108.00126  -129.09603
   23    22 S   O    _O2_    23     1.22999   122.36637  -144.90349
   24    20 S   CT   _CB2    32     1.53412   111.22063   108.84444
   25    24 S   HC   HB21    33     1.09439   109.69229    53.57433
   26    24 S   HC   HB22    34     1.09531   110.39829   171.48336
   27    22 S   N    _N3_    24     1.38546   113.28380    42.40040
   28    27 S   H    _HN3    25     1.01526   118.89840    -0.53632
   29    24 S   S    _SG2    35     1.83148   111.61526   -70.32577
   30    27 S   CT   _CA3    26     1.45455   123.50051   175.10767
   31    30 S   HC   HA31    27     1.09519   109.29353    23.15556
   32    30 S   HC   HA32    28     1.09496   107.10168   140.18368
   33    29 S   CT   _C11    36     1.86210   102.05247   133.10955
   34    30 S   CO3  _C3_    29     1.52929   113.10393  -100.35384
   35    34 S   O2Z  _O31    30     1.26403   115.41232   -43.66121
   36    34 S   O2Z  _O32    31     1.26355   114.97363   137.26708
   37    33 S   CM   _C4_    37     1.52400   106.94171  -177.37542
   38    33 S   S    _S21    59     1.83819   110.00069    58.64929
   39    37 S   N4   _N13    38     1.35827   107.82027    97.81947
   40    37 S   CMA  _C7_    56     1.51320   125.80531   -91.97747
   41    40 S   OM   _O16    57     1.26325   121.36290  -115.21315
   42    40 S   OM   _O17    58     1.26223   120.60494    63.54650
   43    38 S   CT   _C14    60     1.82790   102.42149  -177.84206
   44    43 S   HC   _H32    61     1.09441   107.89073    94.02077
   45    43 S   HC   _H33    62     1.09274   111.40206   -24.53428
   46    39 S   C4   _C5_    39     1.34485   137.94262   139.18765
   47    46 S   O    _O18    40     1.20865   134.44842    33.43038
   48    39 S   C4T  _C10    43     1.45129   114.63299    -1.75111
   49    48 S   HC   _H26    44     1.09892   111.16673   -97.10281
   50    43 S   CT   _C13    63     1.52540   110.28274  -146.44891
   51    50 S   HC   _H30    64     1.09570   111.41763   -54.05663
   52    50 S   HC   _H31    65     1.09508   109.68702  -173.98210
   53    46 S   C4T  _C9_    41     1.56777    89.49542  -141.15555
   54    53 S   HC   _H25    42     1.09890   111.13204  -115.14184
   55    33 S   CT   _C8_    45     1.56295   110.85503   -67.56798
   56    55 S   HC   _H23    46     1.09430   111.89514   159.46894
   57    55 S   HC   _H24    47     1.09355   113.99479    38.49965
   58    50 S   NG   _N15    66     1.47011   109.80249    67.84950
   59    58 S   H    _H37    67     1.02279   119.66966    16.65012
   60    53 S   CT   _C15    48     1.52192   115.18581   116.38923
   61    60 S   HC   _H34    49     1.09529   111.21469   -48.45985
   62    58 S   CG   _C6_    68     1.32320   124.38236  -162.95783
   63    62 S   HC   _H22    69     1.07861   115.58537   179.43698
   64    60 S   CT   _C12    50     1.52170   110.47143  -171.27058
   65    64 S   HC   _H27    51     1.09552   110.88518   -61.11499
   66    64 S   HC   _H28    52     1.09520   110.48471  -179.19037
   67    64 S   HC   _H29    53     1.09380   111.78329    59.79788
   68    60 S   OH   _O19    54     1.42560   108.30595    69.79985
   69    68 S   HO   _H38    55     0.97220   107.56587  -179.19936
   70    62 S   NG   _N14    70     1.32142   128.49195    -0.67869
   71    70 S   H    _H35    71     1.01354   120.24806   179.91377
   72    70 S   H    _H36    72     1.01242   121.10003    -0.10087
  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  10   5   4   3
  17   2   1   1  14  13  13   5   1   1   9   5   4  10   4  10
   6   7   4   3  12   5   3   1   1   6   3   7   6   4   3   5
   3   2   1   1   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    55    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    39    48    55    56    57    40    38    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    39    46    53    48    49    55    56    57    40    41    42    38    43    44    45    50  
   35    36  
   36  
    0  
   39    46    47    53    48    49    55    56    57    40    41    42    38    43  
   43    44    45    50    51    52    58    39    40    48    55    56    57  
   46    47    53    54    48    49    55    56    57    60    40    41    42  
   41    42    46    48    55  
   42  
    0  
   44    45    50    51    52    58    59    62    55  
   45    50    51    52    58  
   50    51    52    58  
   47    53    54    48    49    55    60    61    64    68  
   53    54    48    60  
   49    55    56    57    60    61    64    68    53    54  
   55    56    57    60    53    54  
   51    52    58    59    62    63    70  
   52    58    59    62  
   58    59    62  
   54    55    56    57    60    61    64    65    66    67    68    69  
   55    60    61    64    68  
   56    57    60  
   57  
    0  
   59    62    63    70    71    72  
   62    63    70  
   61    64    65    66    67    68    69  
   64    65    66    67    68    69  
   63    70    71    72  
   70    71    72  
   65    66    67    68    69  
   66    67    68  
   67    68  
   68  
   69  
    0  
   71    72  
   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  -0.335000   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   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.549900   2.0020   1.7750   0.023028004  -0.852763146
   38   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   39   3.2500   0.1700  -0.296300   1.8100   1.6000   0.054801302  -1.445846770
   40   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   42   3.1500   0.2500  -0.773900   1.7000   1.5000   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   3.7500   0.1050   0.665000   1.9250   1.7000   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   48   3.5000   0.0660   0.003700   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   50   3.5000   0.0660   0.192400   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.154800   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.061200   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.2500   0.1700  -0.340900   2.2900   2.0360   0.003973653   1.685851020
   59   0.0000   0.0000   0.345100   0.9960   0.8600   0.030040813  -0.651083722
   60   3.5000   0.0660   0.263800   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.2500   0.0500   0.371400   2.0020   1.7750   0.023028004  -0.852763146
   63   2.4200   0.0300   0.139100   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   70   3.2500   0.1700  -0.747100   1.8650   1.6500   0.051222218  -2.220205820
   71   0.0000   0.0000   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   72   0.0000   0.0000   0.460000   0.9960   0.8600   0.030040813  -0.651083722
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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.510
   33    55   268.000  1.529
   33    38   222.000  1.810
   37    39   400.000  1.384
   37    40   465.000  1.376
   39    46   440.000  1.369
   39    48   305.000  1.456
   46    47   930.000  1.212
   46    53   250.000  1.540
   53    54   340.000  1.090
   53    48   268.000  1.529
   53    60   260.000  1.519
   48    49   340.000  1.090
   48    55   260.000  1.519
   55    56   340.000  1.090
   55    57   340.000  1.090
   60    61   340.000  1.090
   60    64   268.000  1.529
   60    68   320.000  1.410
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   68    69   553.000  0.945
   40    41   745.000  1.250
   40    42   745.000  1.250
   38    43   222.000  1.810
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    58   337.000  1.463
   58    59   434.000  1.010
   58    62   481.000  1.340
   62    63   385.000  1.083
   62    70   481.000  1.340
   70    71   434.000  1.010
   70    72   434.000  1.010
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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  112.20000
   29    33    55    75.00000  111.63000
   29    33    38    75.00000  118.28000
   33    37    39    70.00000  113.82800
   33    37    40    70.00000  124.00000
   33    55    48    70.00000  112.98000
   33    55    56    37.50000  110.70000
   33    55    57    37.50000  110.70000
   33    38    43    62.00000   98.90000
   37    39    46    50.00000  132.10000
   37    39    48    50.00000  132.70000
   37    40    41    65.00000  137.10300
   37    40    42    65.00000  137.10300
   39    46    47    75.00000  131.60000
   39    46    53    95.00000   92.72400
   39    48    53   105.00000   87.49700
   39    48    49    50.00000  112.01000
   39    48    55    80.00000  110.05700
   46    53    54    40.00000  113.37500
   46    53    48   100.00000   86.36000
   46    53    60    63.00000  111.10000
   53    46    47    60.00000  136.58000
   53    48    49    37.50000  110.70000
   53    48    55    65.00000  119.52000
   53    60    61    45.00000  111.22300
   53    60    64    70.00000  112.98000
   53    60    68    50.00000  109.50000
   48    39    46   100.00000   93.00000
   48    53    54    37.50000  110.70000
   48    55    56    45.00000  111.22300
   48    55    57    45.00000  111.22300
   55    33    37    70.00000  112.02700
   55    48    49    45.00000  112.72800
   57    55    56    33.00000  107.80000
   60    53    54    45.00000  112.72800
   60    53    48    65.00000  119.52000
   60    64    65    37.50000  110.70000
   60    64    66    37.50000  110.70000
   60    64    67    37.50000  110.70000
   60    68    69    55.00000  108.50000
   64    60    61    37.50000  110.70000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   68    60    61    35.00000  109.50000
   68    60    64    50.00000  109.50000
   40    37    39    75.00000  120.83300
   42    40    41    65.00000  121.00000
   38    33    37    75.00000  112.20000
   38    33    55    75.00000  111.63000
   38    43    44    35.00000  109.50000
   38    43    45    35.00000  109.50000
   38    43    50    75.00000  111.63000
   43    50    51    37.50000  110.70000
   43    50    52    37.50000  110.70000
   43    50    58    80.00000  111.20000
   45    43    44    33.00000  107.80000
   50    43    44    37.50000  110.70000
   50    43    45    37.50000  110.70000
   50    58    59    35.00000  118.40000
   50    58    62    50.00000  123.20000
   52    50    51    33.00000  107.80000
   58    50    51    35.00000  109.50000
   58    50    52    35.00000  109.50000
   58    62    63    45.00000  116.52200
   58    62    70    70.00000  120.00000
   62    58    59    35.00000  120.00000
   62    70    71    35.00000  120.00000
   62    70    72    35.00000  120.00000
   70    62    63    45.00000  116.52200
   72    70    71    35.00000  120.00000
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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    55   0.01700  1.0 1.0
   24    29    33    55  -0.23550 -1.0 2.0
   24    29    33    55   0.21350  1.0 3.0
   24    29    33    38   0.08500  1.0 1.0
   24    29    33    38  -0.53150 -1.0 2.0
   24    29    33    38   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    37    39   0.09700  1.0 1.0
   29    33    37    39   0.15600 -1.0 2.0
   29    33    37    39  -0.50800  1.0 3.0
   29    33    37    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    55    48   0.44750  1.0 1.0
   29    33    55    48  -0.17800 -1.0 2.0
   29    33    55    48   0.20200  1.0 3.0
   29    33    55    56   0.15000  1.0 3.0
   29    33    55    57   0.15000  1.0 3.0
   29    33    38    43   0.08500  1.0 1.0
   29    33    38    43  -0.53150 -1.0 2.0
   29    33    38    43   0.48050  1.0 3.0
   33    37    39    46   0.00000  1.0 1.0
   33    37   -39    48   0.00000  1.0 1.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37    40    42   7.00000 -1.0 2.0
   33    38    43    44   0.32350  1.0 3.0
   33    38    43    45   0.32350  1.0 3.0
   33    38    43    50   0.01700  1.0 1.0
   33    38    43    50  -0.23550 -1.0 2.0
   33    38    43    50   0.21350  1.0 3.0
   37    33   -55    48   0.34400  1.0 1.0
   37    33   -55    48   0.09450 -1.0 2.0
   37    33   -55    48   0.11100  1.0 3.0
   37    33    55    56   0.15000  1.0 3.0
   37    33    55    57   0.15000  1.0 3.0
   37    33    38    43  -0.62250  1.0 1.0
   37    33    38    43  -0.38450 -1.0 2.0
   37    33    38    43   0.81900  1.0 3.0
   37    39    46    47   3.00000 -1.0 2.0
   37    39    46    53   3.00000 -1.0 2.0
   37    39   -48    53   0.00000  1.0 1.0
   37    39    48    49   0.00000  1.0 1.0
   37    39   -48    55   0.00000  1.0 1.0
   39    37    40    41   7.00000 -1.0 2.0
   39    37    40    42   7.00000 -1.0 2.0
   39    46    53    54   0.00000  1.0 1.0
   39    46   -53    48   3.00000 -1.0 2.0
   39    46    53    60   1.39750  1.0 1.0
   39    46    53    60  -0.07950 -1.0 2.0
   39    46    53    60  -0.18750  1.0 3.0
   39    48   -55    33   0.43900  1.0 1.0
   39    48   -55    33   0.49100 -1.0 2.0
   39    48   -55    33   0.28400  1.0 3.0
   39    48    55    56   0.15000  1.0 3.0
   39    48    55    57   0.15000  1.0 3.0
   46    39   -48    53   0.00000  1.0 1.0
   46    39    48    49   0.00000  1.0 1.0
   46    39    48    55   0.00000  1.0 1.0
   46    53   -48    39   3.00000 -1.0 2.0
   46    53   -48    49   0.15000  1.0 3.0
   46    53   -48    55  -0.95700  1.0 1.0
   46    53   -48    55  -0.18200 -1.0 2.0
   46    53   -48    55   0.29450  1.0 3.0
   46    53    60    61  -0.11250  1.0 3.0
   46    53    60    64  -0.95700  1.0 1.0
   46    53    60    64  -0.18200 -1.0 2.0
   46    53    60    64   0.29450  1.0 3.0
   46    53    60    68  -0.09450  1.0 1.0
   46    53    60    68  -1.12950 -1.0 2.0
   46    53    60    68   0.54000  1.0 3.0
   47    46    53    54   0.00000  1.0 1.0
   47    46    53    48  -0.11250  1.0 1.0
   47    46    53    48   0.11400 -1.0 2.0
   47    46    53    48  -0.28950  1.0 3.0
   47    46    53    60   0.30150 -1.0 2.0
   53    48    55    33   0.04050  1.0 1.0
   53    48    55    33   0.63700 -1.0 2.0
   53    48    55    33   0.17650  1.0 3.0
   53    48    55    56   0.00000  1.0 1.0
   53    48    55    57   0.00000  1.0 1.0
   53    60    64    65   0.15000  1.0 3.0
   53    60    64    66   0.15000  1.0 3.0
   53    60    64    67   0.15000  1.0 3.0
   53    60    68    69  -0.11600  1.0 1.0
   53    60    68    69  -0.09450 -1.0 2.0
   53    60    68    69   0.21250  1.0 3.0
   54    53   -48    39   0.15000  1.0 3.0
   54    53    48    49   0.15000  1.0 3.0
   54    53    48    55   0.15000  1.0 3.0
   54    53    60    61   0.15000  1.0 3.0
   54    53    60    64   0.15000  1.0 3.0
   54    53    60    68   0.23400  1.0 3.0
   48    39   -46    47   3.00000 -1.0 2.0
   48    39   -46    53   3.00000 -1.0 2.0
   48    53    60    61   0.00000  1.0 1.0
   48    53    60    64   0.04050  1.0 1.0
   48    53    60    64   0.63700 -1.0 2.0
   48    53    60    64   0.17650  1.0 3.0
   48    53    60    68   0.86500  1.0 1.0
   48    53    60    68  -0.17500 -1.0 2.0
   48    53    60    68   0.20800  1.0 3.0
   49    48    55    33   0.15000  1.0 3.0
   49    48    55    56   0.15000  1.0 3.0
   49    48    55    57   0.15000  1.0 3.0
   55    33   -37    39  -0.93550  1.0 1.0
   55    33   -37    39   0.38900 -1.0 2.0
   55    33   -37    39   0.16950  1.0 3.0
   55    33    37    40   0.09850  1.0 1.0
   55    33    37    40   0.15250 -1.0 2.0
   55    33    37    40  -0.50650  1.0 3.0
   55    33    38    43   0.01700  1.0 1.0
   55    33    38    43  -0.23550 -1.0 2.0
   55    33    38    43   0.21350  1.0 3.0
   60    53   -48    39   0.43900  1.0 1.0
   60    53   -48    39   0.49100 -1.0 2.0
   60    53   -48    39   0.28400  1.0 3.0
   60    53    48    49   0.15000  1.0 3.0
   60    53    48    55   0.56750  1.0 1.0
   60    53    48    55  -0.07550 -1.0 2.0
   60    53    48    55   0.20000  1.0 3.0
   61    60    64    65   0.15000  1.0 3.0
   61    60    64    66   0.15000  1.0 3.0
   61    60    64    67   0.15000  1.0 3.0
   61    60    68    69   0.19450  1.0 3.0
   64    60    68    69  -0.11600  1.0 1.0
   64    60    68    69  -0.09450 -1.0 2.0
   64    60    68    69   0.21250  1.0 3.0
   68    60    64    65   0.23400  1.0 3.0
   68    60    64    66   0.23400  1.0 3.0
   68    60    64    67   0.23400  1.0 3.0
   40    37    39    46   0.00000  1.0 1.0
   40    37    39    48   0.00000  1.0 1.0
   38    33    37    39   0.09700  1.0 1.0
   38    33    37    39   0.15600 -1.0 2.0
   38    33    37    39  -0.50800  1.0 3.0
   38    33    37    40   0.42700  1.0 1.0
   38    33    37    40  -0.70350 -1.0 2.0
   38    33    37    40  -0.43150  1.0 3.0
   38    33    55    48   0.44750  1.0 1.0
   38    33    55    48  -0.17800 -1.0 2.0
   38    33    55    48   0.20200  1.0 3.0
   38    33    55    56   0.15000  1.0 3.0
   38    33    55    57   0.15000  1.0 3.0
   38    43    50    51   0.15000  1.0 3.0
   38    43    50    52   0.15000  1.0 3.0
   38    43    50    58   0.56750  1.0 1.0
   38    43    50    58  -0.07550 -1.0 2.0
   38    43    50    58   0.20000  1.0 3.0
   43    50    58    59  -0.09500  1.0 1.0
   43    50    58    59  -0.20850 -1.0 2.0
   43    50    58    59   0.20900  1.0 3.0
   43    50    58    62   0.25550 -1.0 2.0
   44    43    50    51   0.15000  1.0 3.0
   44    43    50    52   0.15000  1.0 3.0
   44    43    50    58  -0.29100  1.0 3.0
   45    43    50    51   0.15000  1.0 3.0
   45    43    50    52   0.15000  1.0 3.0
   45    43    50    58  -0.29100  1.0 3.0
   50    58    62    63  -0.09200  1.0 1.0
   50    58    62    63   0.68550 -1.0 2.0
   50    58    62    70   3.96800 -1.0 2.0
   51    50    58    59   0.00000  1.0 1.0
   51    50    58    62   0.08850  1.0 3.0
   52    50    58    59   0.00000  1.0 1.0
   52    50    58    62   0.08850  1.0 3.0
   58    62    70    71   1.50000 -1.0 2.0
   58    62    70    72   1.50000 -1.0 2.0
   59    58    62    63   1.00000 -1.0 2.0
   59    58    62    70   1.50000 -1.0 2.0
   63    62    70    71   1.00000 -1.0 2.0
   63    62    70    72   1.00000 -1.0 2.0
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
   36    30    34    35  10.50000 -1.0 2.0
   33    39    37    40   1.10000 -1.0 2.0
   48    46    39    37   1.00000 -1.0 2.0
   39    53    46    47  10.50000 -1.0 2.0
   41    42    40    37   1.10000 -1.0 2.0
   50    59    58    62   1.00000 -1.0 2.0
   70    63    62    58  10.50000 -1.0 2.0
   72    62    70    71   1.00000 -1.0 2.0
END
