* LIGAND DATABASE FILE (OPLS2005)
*
001      70    70    128    191     376
    1     0 S   NP   _N1_     1    29.00908    95.28273   -19.28987
    2     1 S   H    _HN1     2     1.02988    95.56804    34.37046
    3     1 S   H    _H1_     3     1.02827    38.70635   144.80881
    4     1 S   H    _H2_     4     1.02774    77.23001   -73.15080
    5     1 S   CT   _CA1     5     1.50155   146.54729   175.64387
    6     5 S   HC   _HA1     6     1.09577   105.25538    39.26690
    7     5 S   CO3  _C1_     7     1.53811   112.43181   -80.81312
    8     7 S   O2Z  _O11     8     1.26336   115.05930   -41.71056
    9     7 S   O2Z  _O12     9     1.26253   114.91814   137.47428
   10     5 S   CT   _CB1    10     1.53053   107.28746   157.04614
   11    10 S   HC   HB11    11     1.09817   109.24568   -52.16944
   12    10 S   HC   HB12    12     1.09739   110.25881    64.18262
   13    10 S   CT   _CG1    13     1.52969   112.95364  -173.53728
   14    13 S   HC   HG11    14     1.09591   110.23311   -62.25107
   15    13 S   HC   HG12    15     1.09620   110.23457    56.97386
   16    13 S   C    _CD1    16     1.51833   112.13830   177.12281
   17    16 S   O    _OE1    17     1.22727   123.18848   -13.55873
   18    16 S   N    _N2_    18     1.38588   111.72684   167.13261
   19    18 S   H    _HN2    19     1.01596   119.00481     0.94523
   20    18 S   CT1  _CA2    20     1.46260   123.45847  -178.29498
   21    20 S   HC   _HA2    21     1.09734   109.34178   -16.50382
   22    20 S   C    _C2_    22     1.53407   108.20999  -132.19240
   23    22 S   O    _O2_    23     1.23005   122.30238  -145.49763
   24    20 S   CT   _CB2    32     1.53497   111.29704   105.69293
   25    24 S   HC   HB21    33     1.09553   109.55476    53.84216
   26    24 S   HC   HB22    34     1.09475   110.55446   172.51559
   27    22 S   N    _N3_    24     1.38530   113.30227    41.87764
   28    27 S   H    _HN3    25     1.01533   118.91018    -0.52749
   29    24 S   S    _SG2    35     1.83009   111.57777   -68.11202
   30    27 S   CT   _CA3    26     1.45449   123.41430   175.10943
   31    30 S   HC   HA31    27     1.09526   109.18708    25.20746
   32    30 S   HC   HA32    28     1.09494   107.12892   142.20844
   33    29 S   CT   _C11    36     1.85283   100.37075   149.75009
   34    33 S   HC   _H3_    37     1.08998   105.23149   -38.82902
   35    30 S   CO3  _C3_    29     1.52932   113.17148   -98.23407
   36    35 S   O2Z  _O31    30     1.26398   115.43601   -43.60275
   37    35 S   O2Z  _O32    31     1.26359   114.96152   137.34339
   38    33 S   CT   _C10    38     1.59802   113.44279  -156.37045
   39    33 S   CT   _C12    62     1.54705   107.83082    74.28078
   40    39 S   HC   _H10    63     1.09162   111.25878    83.94144
   41    39 S   HC   _H11    64     1.09649   111.70510   -35.56924
   42    38 S   CM   _C5_    39     1.54499   113.33945   -41.28923
   43    38 S   OH   _O35    60     1.44227   107.63454  -161.11628
   44    43 S   HO   _H15    61     0.96958   109.65148    67.39047
   45    39 S   CO4  _C13    65     1.52376   113.52519  -153.44207
   46    45 S   O    _O34    66     1.22986   122.83229    22.30761
   47    42 S   CM   _C6_    40     1.34627   122.46026   101.23945
   48    47 S   HC   _H7_    41     1.08541   121.79873  -179.59749
   49    42 S   CT   _C4_    56     1.50785   119.72756   -78.76914
   50    49 S   HC   _H4_    57     1.09386   111.15960   -58.39445
   51    49 S   HC   _H5_    58     1.09630   111.98898  -177.30775
   52    49 S   HC   _H6_    59     1.09146   111.16196    63.65628
   53    45 S   CT   _C14    67     1.50666   116.18351  -160.25547
   54    53 S   HC   _H12    68     1.09282   109.56834    60.59405
   55    53 S   HC   _H13    69     1.09266   109.55219   -60.48714
   56    53 S   HC   _H14    70     1.09351   109.72546   179.90309
   57    47 S   CO4  _C7_    42     1.48118   122.50422    -0.82898
   58    57 S   O    _O33    43     1.23033   119.37331  -174.62057
   59    57 S   CT   _C8_    44     1.50896   119.08902     3.60250
   60    59 S   HC   _H8_    45     1.09703   107.55343   144.58634
   61    59 S   HC   _H9_    46     1.09345   108.07228  -100.38036
   62    38 S   CT   _C9_    47     1.59816   113.95353    84.16118
   63    62 S   CT   _C15    48     1.56207   110.82641   163.51417
   64    63 S   HC   _H16    49     1.09590   111.48355   -66.30012
   65    63 S   HC   _H17    50     1.09676   110.93652   174.81760
   66    63 S   HC   _H18    51     1.09391   112.77559    54.76220
   67    62 S   CT   _C16    52     1.54770   112.97512    45.82287
   68    67 S   HC   _H19    53     1.09504   111.46057    49.47304
   69    67 S   HC   _H20    54     1.09453   112.23509   -72.43740
   70    67 S   HC   _H21    55     1.09688   110.98002   169.15305
  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   8   2   1   1  26  11   4   3  14   7   1   5   4  11   4
   5   2   1   1   3   2   1   1   7   4  11   4   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    62    43    39    40    41    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    47    59    62    63    67    49    43    44    39    40    41    45    46    53  
   38    42    62    43    39    40    41    45  
   36    37  
   37  
    0  
   42    47    48    57    59    60    61    62    63    64    65    66    67    68    69    70    49    50    51    52    43    44    39    40    41    45  
   40    41    45    46    53    54    55    56    42    43    62  
   41    45    46    53  
   45    46    53  
   47    48    57    58    59    62    63    67    49    50    51    52    43    44  
   44    47    49    59    62    63    67  
   62  
   46    53    54    55    56  
   53    54    55    56  
   48    57    58    59    60    61    62    49    50    51    52  
   57    58    59    49  
   50    51    52    57    62  
   51    52  
   52  
    0  
   54    55    56  
   55    56  
   56  
    0  
   58    59    60    61    62    63    67  
   59    60    61    62  
   60    61    62    63    64    65    66    67    68    69    70  
   61    62    63    67  
   62    63    67  
   63    64    65    66    67    68    69    70  
   64    65    66    67    68    69    70  
   65    66    67  
   66    67  
   67  
   68    69    70  
   69    70  
   70  
    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   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   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   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   58   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   59   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   63   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   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   340.000  1.090
   33    38   268.000  1.529
   33    39   268.000  1.529
   38    42   317.000  1.510
   38    62   268.000  1.529
   38    43   320.000  1.410
   42    47   549.000  1.340
   42    49   317.000  1.510
   47    48   340.000  1.080
   47    57   320.000  1.462
   57    58   570.000  1.229
   57    59   317.000  1.522
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   268.000  1.529
   62    63   268.000  1.529
   62    67   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   43    44   553.000  0.945
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    45   317.000  1.522
   45    46   570.000  1.229
   45    53   317.000  1.522
   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  111.63000
   29    33    39    75.00000  111.63000
   33    38    42    70.00000  112.02700
   33    38    62    58.35000  112.70000
   33    38    43    50.00000  109.50000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    45    63.00000  111.10000
   38    33    34    37.50000  110.70000
   38    42    47    70.00000  124.00000
   38    42    49    65.00000  117.92700
   38    62    59    58.35000  112.70000
   38    62    63    58.35000  112.70000
   38    62    67    58.35000  112.70000
   38    43    44    55.00000  108.50000
   42    47    48    35.00000  120.00000
   42    47    57    65.00000  118.96000
   42    49    50    35.00000  109.50000
   42    49    51    35.00000  109.50000
   42    49    52    35.00000  109.50000
   47    57    58    80.00000  123.72100
   47    57    59    65.00000  118.62400
   57    47    48    40.00000  117.72500
   57    59    60    35.00000  109.50000
   57    59    61    35.00000  109.50000
   57    59    62    63.00000  111.10000
   59    57    58    80.00000  120.40000
   59    62    63    58.35000  112.70000
   59    62    67    58.35000  112.70000
   61    59    60    33.00000  107.80000
   62    38    42    70.00000  112.02700
   62    59    60    37.50000  110.70000
   62    59    61    37.50000  110.70000
   62    63    64    37.50000  110.70000
   62    63    65    37.50000  110.70000
   62    63    66    37.50000  110.70000
   62    67    68    37.50000  110.70000
   62    67    69    37.50000  110.70000
   62    67    70    37.50000  110.70000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   67    62    63    58.35000  112.70000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   49    42    47    70.00000  124.00000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   43    38    42    90.00000  110.39200
   43    38    62    50.00000  109.50000
   39    33    34    37.50000  110.70000
   39    33    38    58.35000  112.70000
   39    45    46    80.00000  120.40000
   39    45    53    70.00000  116.00000
   41    39    40    33.00000  107.80000
   45    39    40    35.00000  109.50000
   45    39    41    35.00000  109.50000
   45    53    54    35.00000  109.50000
   45    53    55    35.00000  109.50000
   45    53    56    35.00000  109.50000
   53    45    46    80.00000  120.40000
   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   0.01700  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    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  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    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    38    62   0.44750  1.0 1.0
   29    33    38    62  -0.17800 -1.0 2.0
   29    33    38    62   0.20200  1.0 3.0
   29    33    38    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    45   0.56750  1.0 1.0
   29    33    39    45  -0.07550 -1.0 2.0
   29    33    39    45   0.20000  1.0 3.0
   33    38    42    47   0.09850  1.0 1.0
   33    38    42    47   0.15250 -1.0 2.0
   33    38    42    47  -0.50650  1.0 3.0
   33    38    42    49   0.46850  1.0 1.0
   33    38    42    49   0.08550 -1.0 2.0
   33    38    42    49   0.09800  1.0 3.0
   33    38    62    59   0.56750  1.0 1.0
   33    38    62    59  -0.07550 -1.0 2.0
   33    38    62    59   0.20000  1.0 3.0
   33    38    62    63   0.56750  1.0 1.0
   33    38    62    63  -0.07550 -1.0 2.0
   33    38    62    63   0.20000  1.0 3.0
   33    38    62    67   0.56750  1.0 1.0
   33    38    62    67  -0.07550 -1.0 2.0
   33    38    62    67   0.20000  1.0 3.0
   33    38    43    44  -0.11600  1.0 1.0
   33    38    43    44  -0.09450 -1.0 2.0
   33    38    43    44   0.21250  1.0 3.0
   33    39    45    46   0.30150 -1.0 2.0
   33    39    45    53   0.60050  1.0 1.0
   33    39    45    53   0.05600 -1.0 2.0
   33    39    45    53   0.26150  1.0 3.0
   34    33    38    42   0.15000  1.0 3.0
   34    33    38    62   0.15000  1.0 3.0
   34    33    38    43   0.23400  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    45  -0.11250  1.0 3.0
   38    33    39    40   0.15000  1.0 3.0
   38    33    39    41   0.15000  1.0 3.0
   38    33    39    45  -0.95700  1.0 1.0
   38    33    39    45  -0.18200 -1.0 2.0
   38    33    39    45   0.29450  1.0 3.0
   38    42    47    48   7.00000 -1.0 2.0
   38    42    47    57   7.00000 -1.0 2.0
   38    42    49    50   0.34800  1.0 3.0
   38    42    49    51   0.34800  1.0 3.0
   38    42    49    52   0.34800  1.0 3.0
   38    62    63    64   0.15000  1.0 3.0
   38    62    63    65   0.15000  1.0 3.0
   38    62    63    66   0.15000  1.0 3.0
   38    62    67    68   0.15000  1.0 3.0
   38    62    67    69   0.15000  1.0 3.0
   38    62    67    70   0.15000  1.0 3.0
   42    38    62    59   0.34400  1.0 1.0
   42    38    62    59   0.09450 -1.0 2.0
   42    38    62    59   0.11100  1.0 3.0
   42    38    62    63   0.34400  1.0 1.0
   42    38    62    63   0.09450 -1.0 2.0
   42    38    62    63   0.11100  1.0 3.0
   42    38    62    67   0.34400  1.0 1.0
   42    38    62    67   0.09450 -1.0 2.0
   42    38    62    67   0.11100  1.0 3.0
   42    38    43    44  -0.07800  1.0 1.0
   42    38    43    44  -0.21500 -1.0 2.0
   42    38    43    44  -0.03150  1.0 3.0
   42    47    57    58   1.00000 -1.0 2.0
   42    47   -57    59  -0.33500  1.0 1.0
   42    47   -57    59   1.06600 -1.0 2.0
   42    47   -57    59  -0.14000  1.0 3.0
   47    42    49    50   0.00000  1.0 1.0
   47    42    49    51   0.00000  1.0 1.0
   47    42    49    52   0.00000  1.0 1.0
   47    57    59    60   0.00000  1.0 1.0
   47    57    59    61   0.00000  1.0 1.0
   47    57    59    62   0.65300  1.0 1.0
   47    57    59    62  -0.03850 -1.0 2.0
   47    57    59    62   0.33900  1.0 3.0
   48    47    57    58   0.00000  1.0 1.0
   48    47    57    59   0.04550  1.0 1.0
   48    47    57    59   0.83000 -1.0 2.0
   48    47    57    59  -0.04000  1.0 3.0
   57    59   -62    38  -0.95700  1.0 1.0
   57    59   -62    38  -0.18200 -1.0 2.0
   57    59   -62    38   0.29450  1.0 3.0
   57    59    62    63  -0.95700  1.0 1.0
   57    59    62    63  -0.18200 -1.0 2.0
   57    59    62    63   0.29450  1.0 3.0
   57    59    62    67  -0.95700  1.0 1.0
   57    59    62    67  -0.18200 -1.0 2.0
   57    59    62    67   0.29450  1.0 3.0
   58    57    59    60   0.00000  1.0 1.0
   58    57    59    61   0.00000  1.0 1.0
   58    57    59    62   0.30150 -1.0 2.0
   59    62    63    64   0.15000  1.0 3.0
   59    62    63    65   0.15000  1.0 3.0
   59    62    63    66   0.15000  1.0 3.0
   59    62    67    68   0.15000  1.0 3.0
   59    62    67    69   0.15000  1.0 3.0
   59    62    67    70   0.15000  1.0 3.0
   60    59    62    38   0.15000  1.0 3.0
   60    59    62    63   0.15000  1.0 3.0
   60    59    62    67   0.15000  1.0 3.0
   61    59    62    38   0.15000  1.0 3.0
   61    59    62    63   0.15000  1.0 3.0
   61    59    62    67   0.15000  1.0 3.0
   62    38   -42    47   0.09850  1.0 1.0
   62    38   -42    47   0.15250 -1.0 2.0
   62    38   -42    47  -0.50650  1.0 3.0
   62    38    42    49   0.46850  1.0 1.0
   62    38    42    49   0.08550 -1.0 2.0
   62    38    42    49   0.09800  1.0 3.0
   62    38    43    44  -0.11600  1.0 1.0
   62    38    43    44  -0.09450 -1.0 2.0
   62    38    43    44   0.21250  1.0 3.0
   63    62    67    68   0.15000  1.0 3.0
   63    62    67    69   0.15000  1.0 3.0
   63    62    67    70   0.15000  1.0 3.0
   67    62    63    64   0.15000  1.0 3.0
   67    62    63    65   0.15000  1.0 3.0
   67    62    63    66   0.15000  1.0 3.0
   49    42    47    48   7.00000 -1.0 2.0
   49    42    47    57   7.00000 -1.0 2.0
   43    38    42    47   0.67800  1.0 1.0
   43    38    42    47   0.47050 -1.0 2.0
   43    38    42    47  -0.62500  1.0 3.0
   43    38    42    49   0.18000  1.0 1.0
   43    38    42    49   0.16450 -1.0 2.0
   43    38    42    49   0.04450  1.0 3.0
   43    38    62    59   0.86500  1.0 1.0
   43    38    62    59  -0.17500 -1.0 2.0
   43    38    62    59   0.20800  1.0 3.0
   43    38    62    63   0.86500  1.0 1.0
   43    38    62    63  -0.17500 -1.0 2.0
   43    38    62    63   0.20800  1.0 3.0
   43    38    62    67   0.86500  1.0 1.0
   43    38    62    67  -0.17500 -1.0 2.0
   43    38    62    67   0.20800  1.0 3.0
   39    33    38    42   0.34400  1.0 1.0
   39    33    38    42   0.09450 -1.0 2.0
   39    33    38    42   0.11100  1.0 3.0
   39    33    38    62   0.56750  1.0 1.0
   39    33    38    62  -0.07550 -1.0 2.0
   39    33    38    62   0.20000  1.0 3.0
   39    33    38    43   0.86500  1.0 1.0
   39    33    38    43  -0.17500 -1.0 2.0
   39    33    38    43   0.20800  1.0 3.0
   39    45    53    54   0.00000  1.0 1.0
   39    45    53    55   0.00000  1.0 1.0
   39    45    53    56   0.00000  1.0 1.0
   40    39    45    46   0.00000  1.0 1.0
   40    39    45    53   0.00000  1.0 1.0
   41    39    45    46   0.00000  1.0 1.0
   41    39    45    53   0.00000  1.0 1.0
   46    45    53    54   0.00000  1.0 1.0
   46    45    53    55   0.00000  1.0 1.0
   46    45    53    56   0.00000  1.0 1.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   38    49    42    47   1.10000 -1.0 2.0
   57    48    47    42   1.10000 -1.0 2.0
   47    59    57    58  10.50000 -1.0 2.0
   39    53    45    46  10.50000 -1.0 2.0
END
