* LIGAND DATABASE FILE (OPLS2005)
*
001      61    62    118    186     341
    1     0 S   NP   _N1_     1    28.84657    95.59628   -23.28886
    2     1 S   H    _HN1     2     1.02952    77.13621    14.28791
    3     1 S   H    _H1_     3     1.02827    33.19243   168.35654
    4     1 S   H    _H2_     4     1.02784   104.87971   -91.58502
    5     1 S   CT   _CA1     5     1.50118   136.48443   120.46704
    6     5 S   HC   _HA1     6     1.09573   105.20200    84.97308
    7     5 S   CO3  _C1_     7     1.53789   112.44554   -35.25599
    8     7 S   O2Z  _O11     8     1.26371   115.00782   -42.64499
    9     7 S   O2Z  _O12     9     1.26240   114.94606   136.48164
   10     5 S   CT   _CB1    10     1.53077   107.41209  -157.05549
   11    10 S   HC   HB11    11     1.09832   109.36362   -49.85079
   12    10 S   HC   HB12    12     1.09815   110.43887    66.74344
   13    10 S   CT   _CG1    13     1.52991   112.62923  -170.85204
   14    13 S   HC   HG11    14     1.09584   110.59647   -65.30647
   15    13 S   HC   HG12    15     1.09668   109.83388    53.94032
   16    13 S   C    _CD1    16     1.51791   112.23291   174.36076
   17    16 S   O    _OE1    17     1.22728   123.29166     5.18323
   18    16 S   N    _N2_    18     1.38646   111.68012  -174.89831
   19    18 S   H    _HN2    19     1.01587   118.98285     1.51569
   20    18 S   CT1  _CA2    20     1.46091   123.33313   177.83816
   21    20 S   HC   _HA2    21     1.09592   109.32009     0.36369
   22    20 S   C    _C2_    22     1.53529   108.84840  -114.75479
   23    22 S   O    _O2_    23     1.23062   122.20371  -149.52665
   24    20 S   CT   _CB2    32     1.53271   111.64091   122.77047
   25    24 S   HC   HB21    33     1.09650   109.71574    60.58285
   26    24 S   HC   HB22    34     1.09567   111.01143   178.05952
   27    22 S   N    _N3_    24     1.38311   113.73101    38.03034
   28    27 S   H    _HN3    25     1.01597   119.56081    -3.57451
   29    24 S   S    _SG2    35     1.82864   114.37986   -59.32023
   30    27 S   CT   _CA3    26     1.45283   123.19849   176.97916
   31    30 S   HC   HA31    27     1.09550   107.53049   -63.92786
   32    30 S   HC   HA32    28     1.09557   107.95816    52.50092
   33    29 S   CT   _C12    36     1.82782    99.79078   -66.78921
   34    33 S   HC   _H13    37     1.09223   108.42340   -46.90040
   35    33 S   HC   _H14    38     1.09394   107.56451    69.44903
   36    30 S   CO3  _C3_    29     1.52952   114.08882   174.47816
   37    36 S   O2Z  _O31    30     1.26374   116.06337    -0.80040
   38    36 S   O2Z  _O32    31     1.26427   114.41189   179.25822
   39    33 S   CT   _C9_    39     1.53469   111.59997  -169.80223
   40    39 S   HC   _H5_    40     1.09936   108.98352   -49.06532
   41    39 S   CO4  _C10    41     1.53679   110.82581  -164.24405
   42    41 S   O    _O33    42     1.23057   122.22424    45.38532
   43    41 S   CT   _C11    43     1.52423   116.90840  -137.07384
   44    43 S   HC   _H11    44     1.09510   108.26900   130.87323
   45    43 S   HC   _H12    45     1.09555   107.86687  -112.09313
   46    43 S   C4T  _C6_    46     1.53421   112.66299     9.17584
   47    46 S   HC   _H3_    47     1.09484   112.23029  -179.83929
   48    46 S   C4T  _C7_    48     1.55405   109.62321   -50.89989
   49    48 S   HC   _H9_    49     1.09514   115.30587  -160.20343
   50    48 S   HC   _H10    50     1.09538   116.58398   -34.03931
   51    46 S   C4T  _C5_    53     1.58104   115.54615    45.02491
   52    39 S   C4T  _C8_    51     1.54600   112.23587    71.16652
   53    52 S   HC   _H4_    52     1.09501   113.40836   -53.59288
   54    51 S   CT   _C4_    54     1.54188   114.99008   167.87148
   55    54 S   HC   _H6_    55     1.09582   110.39628   168.73484
   56    54 S   HC   _H7_    56     1.09291   113.51351    48.54359
   57    54 S   HC   _H8_    57     1.09576   110.52641   -71.85096
   58    51 S   CT   _C13    58     1.53059   116.24738    40.94300
   59    58 S   HC   _H15    59     1.09565   110.62408  -168.79690
   60    58 S   HC   _H16    60     1.09598   110.53770    71.96080
   61    58 S   HC   _H17    61     1.09149   113.73380   -48.00434
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   7   5   4   3
  11   5   4   2   1   1  15   7  10   5  11   5   4  15   7   7
   4   3  10   9   2   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    52  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    48    52    53    51  
   35    39    40    41    52  
   39    40    41    52  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    48    49    50    52    53    51    54    58  
   41    42    43    48    52    53    51  
   42    43    44    45    46    47    48    52    53    51  
   43    44    45    46    52  
   44    45    46    47    48    49    50    52    51    54    58  
   45    46    47    48    51  
   46    47    48    51  
   47    48    49    50    52    53    51    54    55    56    57    58    59    60    61  
   48    49    50    52    51    54    58  
   49    50    52    53    51    54    58  
   50    52    53    51  
   52    53    51  
   54    55    56    57    58    59    60    61    52    53  
   53    54    55    56    57    58    59    60    61  
   54    58  
   55    56    57    58    59    60    61  
   56    57    58  
   57    58  
   58  
   59    60    61  
   60    61  
   61  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.001200   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.061200   1.9750   1.7500   0.005000000  -0.741685710
   44   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.118800   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.117600   1.9750   1.7500   0.005000000  -0.741685710
   52   3.5000   0.0660  -0.118800   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.121200   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.121200   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   317.000  1.522
   39    52   260.000  1.519
   41    42   570.000  1.229
   41    43   317.000  1.522
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   260.000  1.519
   46    47   340.000  1.090
   46    48   268.000  1.529
   46    51   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    52   268.000  1.529
   52    53   340.000  1.090
   52    51   268.000  1.529
   51    54   260.000  1.519
   51    58   260.000  1.519
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    63.00000  111.10000
   33    39    52    70.00000  112.98000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    80.00000  120.40000
   39    41    43    70.00000  116.00000
   39    52    48    65.00000  119.52000
   39    52    53    45.00000  112.72800
   39    52    51    65.00000  119.52000
   41    39    40    35.00000  109.50000
   41    43    44    35.00000  109.50000
   41    43    45    35.00000  109.50000
   41    43    46    63.00000  111.10000
   43    41    42    80.00000  120.40000
   43    46    47    45.00000  112.72800
   43    46    48    65.00000  119.52000
   43    46    51    65.00000  119.52000
   45    43    44    33.00000  107.80000
   46    43    44    45.00000  111.22300
   46    43    45    45.00000  111.22300
   46    48    49    37.50000  110.70000
   46    48    50    37.50000  110.70000
   46    48    52    63.00000   92.00000
   46    51    52    63.00000   92.00000
   46    51    54    65.00000  119.52000
   46    51    58    65.00000  119.52000
   48    46    47    37.50000  110.70000
   48    52    53    37.50000  110.70000
   48    52    51    63.00000   92.00000
   50    48    49    33.00000  107.80000
   52    39    40    45.00000  111.22300
   52    39    41    63.00000  111.10000
   52    48    49    37.50000  110.70000
   52    48    50    37.50000  110.70000
   52    51    54    65.00000  119.52000
   52    51    58    65.00000  119.52000
   51    46    47    37.50000  110.70000
   51    46    48    63.00000   92.00000
   51    52    53    37.50000  110.70000
   51    54    55    45.00000  111.22300
   51    54    56    45.00000  111.22300
   51    54    57    45.00000  111.22300
   51    58    59    45.00000  111.22300
   51    58    60    45.00000  111.22300
   51    58    61    45.00000  111.22300
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   58    51    54    58.35000  112.70000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.56750  1.0 1.0
   29    33    39    41  -0.07550 -1.0 2.0
   29    33    39    41   0.20000  1.0 3.0
   29    33    39    52   0.44750  1.0 1.0
   29    33    39    52  -0.17800 -1.0 2.0
   29    33    39    52   0.20200  1.0 3.0
   33    39    41    42   0.30150 -1.0 2.0
   33    39    41    43   0.60050  1.0 1.0
   33    39    41    43   0.05600 -1.0 2.0
   33    39    41    43   0.26150  1.0 3.0
   33    39    52    48   0.04050  1.0 1.0
   33    39    52    48   0.63700 -1.0 2.0
   33    39    52    48   0.17650  1.0 3.0
   33    39    52    53   0.15000  1.0 3.0
   33    39    52    51   0.04050  1.0 1.0
   33    39    52    51   0.63700 -1.0 2.0
   33    39    52    51   0.17650  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41  -0.11250  1.0 3.0
   34    33    39    52   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41  -0.11250  1.0 3.0
   35    33    39    52   0.15000  1.0 3.0
   39    41    43    44   0.00000  1.0 1.0
   39    41    43    45   0.00000  1.0 1.0
   39    41    43    46   0.60050  1.0 1.0
   39    41    43    46   0.05600 -1.0 2.0
   39    41    43    46   0.26150  1.0 3.0
   39    52   -51    46  -0.70950  1.0 1.0
   39    52   -51    46   0.38400 -1.0 2.0
   39    52    51    54   0.56750  1.0 1.0
   39    52    51    54  -0.07550 -1.0 2.0
   39    52    51    54   0.20000  1.0 3.0
   39    52    51    58   0.56750  1.0 1.0
   39    52    51    58  -0.07550 -1.0 2.0
   39    52    51    58   0.20000  1.0 3.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    43   0.00000  1.0 1.0
   40    39    52    48   0.00000  1.0 1.0
   40    39    52    53   0.15000  1.0 3.0
   40    39    52    51   0.00000  1.0 1.0
   41    39    52    48  -0.95700  1.0 1.0
   41    39    52    48  -0.18200 -1.0 2.0
   41    39    52    48   0.29450  1.0 3.0
   41    39    52    53  -0.11250  1.0 3.0
   41    39    52    51  -0.95700  1.0 1.0
   41    39    52    51  -0.18200 -1.0 2.0
   41    39    52    51   0.29450  1.0 3.0
   41    43    46    47  -0.11250  1.0 3.0
   41    43   -46    48  -0.95700  1.0 1.0
   41    43   -46    48  -0.18200 -1.0 2.0
   41    43   -46    48   0.29450  1.0 3.0
   41    43   -46    51  -0.95700  1.0 1.0
   41    43   -46    51  -0.18200 -1.0 2.0
   41    43   -46    51   0.29450  1.0 3.0
   42    41    43    44   0.00000  1.0 1.0
   42    41    43    45   0.00000  1.0 1.0
   42    41    43    46   0.30150 -1.0 2.0
   43    46    48    49   0.15000  1.0 3.0
   43    46    48    50   0.15000  1.0 3.0
   43    46    48    52  -0.70950  1.0 1.0
   43    46    48    52   0.38400 -1.0 2.0
   43    46   -51    52  -0.70950  1.0 1.0
   43    46   -51    52   0.38400 -1.0 2.0
   43    46    51    54   0.56750  1.0 1.0
   43    46    51    54  -0.07550 -1.0 2.0
   43    46    51    54   0.20000  1.0 3.0
   43    46    51    58   0.56750  1.0 1.0
   43    46    51    58  -0.07550 -1.0 2.0
   43    46    51    58   0.20000  1.0 3.0
   44    43    46    47   0.15000  1.0 3.0
   44    43    46    48   0.00000  1.0 1.0
   44    43    46    51   0.00000  1.0 1.0
   45    43    46    47   0.15000  1.0 3.0
   45    43    46    48   0.00000  1.0 1.0
   45    43    46    51   0.00000  1.0 1.0
   46    48   -52    39  -0.70950  1.0 1.0
   46    48   -52    39   0.38400 -1.0 2.0
   46    48    52    53   0.15000  1.0 3.0
   46    48   -52    51   0.00000  1.0 1.0
   46    51    54    55   0.00000  1.0 1.0
   46    51    54    56   0.00000  1.0 1.0
   46    51    54    57   0.00000  1.0 1.0
   46    51    58    59   0.00000  1.0 1.0
   46    51    58    60   0.00000  1.0 1.0
   46    51    58    61   0.00000  1.0 1.0
   47    46    48    49   0.15000  1.0 3.0
   47    46    48    50   0.15000  1.0 3.0
   47    46    48    52   0.15000  1.0 3.0
   47    46   -51    52   0.15000  1.0 3.0
   47    46    51    54   0.15000  1.0 3.0
   47    46    51    58   0.15000  1.0 3.0
   48    46   -51    52   0.00000  1.0 1.0
   48    46    51    54  -0.70950  1.0 1.0
   48    46    51    54   0.38400 -1.0 2.0
   48    46    51    58  -0.70950  1.0 1.0
   48    46    51    58   0.38400 -1.0 2.0
   48    52   -51    46   0.00000  1.0 1.0
   48    52   -51    54  -0.70950  1.0 1.0
   48    52   -51    54   0.38400 -1.0 2.0
   48    52   -51    58  -0.70950  1.0 1.0
   48    52   -51    58   0.38400 -1.0 2.0
   49    48    52    39   0.15000  1.0 3.0
   49    48    52    53   0.15000  1.0 3.0
   49    48    52    51   0.15000  1.0 3.0
   50    48    52    39   0.15000  1.0 3.0
   50    48    52    53   0.15000  1.0 3.0
   50    48    52    51   0.15000  1.0 3.0
   52    39    41    42   0.30150 -1.0 2.0
   52    39   -41    43   0.60050  1.0 1.0
   52    39   -41    43   0.05600 -1.0 2.0
   52    39   -41    43   0.26150  1.0 3.0
   52    51    54    55   0.00000  1.0 1.0
   52    51    54    56   0.00000  1.0 1.0
   52    51    54    57   0.00000  1.0 1.0
   52    51    58    59   0.00000  1.0 1.0
   52    51    58    60   0.00000  1.0 1.0
   52    51    58    61   0.00000  1.0 1.0
   53    52   -51    46   0.15000  1.0 3.0
   53    52    51    54   0.15000  1.0 3.0
   53    52    51    58   0.15000  1.0 3.0
   51    46   -48    49   0.15000  1.0 3.0
   51    46   -48    50   0.15000  1.0 3.0
   51    46   -48    52   0.00000  1.0 1.0
   54    51    58    59   0.15000  1.0 3.0
   54    51    58    60   0.15000  1.0 3.0
   54    51    58    61   0.15000  1.0 3.0
   58    51    54    55   0.15000  1.0 3.0
   58    51    54    56   0.15000  1.0 3.0
   58    51    54    57   0.15000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    36    38  10.50000 -1.0 2.0
   39    43    41    42  10.50000 -1.0 2.0
END
