* LIGAND DATABASE FILE (OPLS2005)
*
001      65    66    120    180     348
    1     0 S   NP   _N1_     1    28.83758    93.98477   -22.13951
    2     1 S   H    _HN1     2     1.02784    96.92572   -81.34376
    3     1 S   H    _H1_     3     1.02921    87.06803    26.81427
    4     1 S   H    _H2_     4     1.02841    27.90415   163.23415
    5     1 S   CT   _CA1     5     1.50090   137.56759   144.46679
    6     5 S   HC   _HA1     6     1.09576   105.19512    68.22373
    7     5 S   CO3  _C1_     7     1.53802   112.38130   -51.98884
    8     7 S   O2Z  _O11     8     1.26360   115.01971   -45.44020
    9     7 S   O2Z  _O12     9     1.26227   114.93100   133.73242
   10     5 S   CT   _CB1    10     1.53107   107.50658  -173.86886
   11    10 S   HC   HB11    11     1.09820   109.43660   -50.05006
   12    10 S   HC   HB12    12     1.09789   110.51386    66.62729
   13    10 S   CT   _CG1    13     1.52980   112.48168  -171.08002
   14    13 S   HC   HG11    14     1.09598   110.46465   -63.68008
   15    13 S   HC   HG12    15     1.09662   109.92983    55.50494
   16    13 S   C    _CD1    16     1.51784   112.37741   175.93442
   17    16 S   O    _OE1    17     1.22737   123.30724     0.56058
   18    16 S   N    _N2_    18     1.38648   111.55439  -179.55325
   19    18 S   H    _HN2    19     1.01606   119.00066     0.64710
   20    18 S   CT1  _CA2    20     1.46169   123.38019   179.81655
   21    20 S   HC   _HA2    21     1.09612   108.96495   -13.11577
   22    20 S   C    _C2_    22     1.53366   108.49047  -128.24961
   23    22 S   O    _O2_    23     1.23022   122.39779  -148.32792
   24    20 S   CT   _CB2    32     1.53434   111.60364   109.31624
   25    24 S   HC   HB21    33     1.09638   109.68289    57.04535
   26    24 S   HC   HB22    34     1.09529   111.42752   174.92125
   27    22 S   N    _N3_    24     1.38376   113.41386    39.27959
   28    27 S   H    _HN3    25     1.01650   119.47982    -3.74356
   29    24 S   S    _SG2    35     1.82785   113.17318   -62.31572
   30    27 S   CT   _CA3    26     1.45283   123.12013   176.84092
   31    30 S   HC   HA31    27     1.09553   107.55536   -63.02338
   32    30 S   HC   HA32    28     1.09558   107.91322    53.37787
   33    29 S   CT   _C10    36     1.84273    99.94100   -78.04507
   34    33 S   HC   _H5_    37     1.09634   107.95629    25.53139
   35    30 S   CO3  _C3_    29     1.52930   114.13470   175.33746
   36    35 S   O2Z  _O31    30     1.26365   116.05270    -0.80162
   37    35 S   O2Z  _O32    31     1.26428   114.41261   179.25087
   38    33 S   CT   _C11    38     1.54192   110.04086   -92.26042
   39    38 S   HC   _H6_    39     1.09644   110.21847    37.26729
   40    38 S   CM   _C12    40     1.49884   114.08980   -85.83672
   41    40 S   HC   _H14    41     1.08678   117.31286   165.16876
   42    38 S   OH   _O33    64     1.42976   108.88227   153.00426
   43    42 S   HO   _H16    65     0.97232   107.85278   179.15373
   44    40 S   CM   _C13    42     1.33958   123.81973   -14.64157
   45    44 S   HC   _H15    43     1.08809   118.28386  -179.84174
   46    44 S   CT   _C8_    44     1.50526   124.23837    -2.57382
   47    46 S   HC   _H3_    45     1.09711   106.16163  -125.46616
   48    33 S   CT   _C9_    46     1.54455   110.69862   142.46236
   49    48 S   HC   _H4_    47     1.09546   109.43119   -50.17277
   50    46 S   S    _S1_    50     1.83928   107.89214   120.77406
   51    48 S   OH   _O34    48     1.43927   107.21457  -162.92373
   52    51 S   HO   _H17    49     0.97243   107.62727   171.63576
   53    50 S   CT   _C7_    51     1.82233    99.57284   159.92276
   54    53 S   HC   _H12    52     1.09344   109.40243    63.19958
   55    53 S   HC   _H13    53     1.09498   108.96893   -54.92367
   56    53 S   CT   _C6_    54     1.52846   110.06717  -175.73226
   57    56 S   HC   _H10    55     1.09750   110.31385   -60.99101
   58    56 S   HC   _H11    56     1.09842   109.76287    56.21717
   59    56 S   C3T  _C5_    57     1.50654   111.53569   177.96212
   60    59 S   NN   _N4_    58     1.42514   117.87421   -75.64772
   61    59 S   CT   _C4_    60     1.49489   117.97498    75.80546
   62    61 S   HC   _H7_    61     1.09575   111.94637   176.95220
   63    61 S   HC   _H8_    62     1.09372   110.29394    57.10647
   64    61 S   HC   _H9_    63     1.09428   110.87382   -62.85875
   65    59 S   NN   _N5_    59     1.42582   117.47012  -134.61725
  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
  15   8   2   1   1  11   6   9   4   3   1   8   4  10   5   5
   3   8   1   1   9   5   4   9   5   4   6   5   4   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    48    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    46    48    49    51    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44    46    47    48    49    51    52    50    42    43  
   38    39    40    46    48    49    51    42  
   36    37  
   37  
    0  
   39    40    41    44    45    46    48    49    51    42    43  
   40    41    44    48    42    43  
   41    44    45    46    47    48    50    42    43  
   44    45    46    42  
   43    44    48  
    0  
   45    46    47    48    49    51    50    53  
   46    47    48    50  
   47    48    49    51    52    50    53    54    55    56  
   48    49    51    50    53  
   49    51    52    50    53  
   51    52    50  
   53    54    55    56    57    58    59    51  
   52  
    0  
   54    55    56    57    58    59    60    65    61  
   55    56    57    58    59  
   56    57    58    59  
   57    58    59    60    65    61    62    63    64  
   58    59    60    65    61  
   59    60    65    61  
   60    65    61    62    63    64  
   65    61    62    63    64  
   62    63    64    65  
   63    64    65  
   64    65  
   65  
    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   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   43   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.107500   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   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660   0.245000   1.9750   1.7500   0.005000000  -0.741685710
   60   3.2500   0.1700  -0.122500   1.8375   1.6250   0.005000000   0.000000000
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.2500   0.1700  -0.122500   1.8375   1.6250   0.005000000   0.000000000
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    48   268.000  1.529
   38    39   340.000  1.090
   38    40   317.000  1.510
   38    42   320.000  1.410
   40    41   340.000  1.080
   40    44   549.000  1.340
   44    45   340.000  1.080
   44    46   317.000  1.510
   46    47   340.000  1.090
   46    48   268.000  1.529
   46    50   222.000  1.810
   48    49   340.000  1.090
   48    51   320.000  1.410
   51    52   553.000  0.945
   50    53   222.000  1.810
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   275.000  1.510
   59    60   255.000  1.500
   59    65   255.000  1.500
   59    61   275.000  1.510
   60    65   470.000  1.265
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   42    43   553.000  0.945
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    48    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    70.00000  112.02700
   33    38    42    50.00000  109.50000
   33    48    46    58.35000  112.70000
   33    48    49    37.50000  110.70000
   33    48    51    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    41    35.00000  117.00000
   38    40    44    70.00000  124.00000
   38    42    43    55.00000  108.50000
   40    38    39    35.00000  109.50000
   40    44    45    35.00000  120.00000
   40    44    46    70.00000  124.00000
   44    40    41    35.00000  120.00000
   44    46    47    35.00000  109.50000
   44    46    48    70.00000  112.02700
   44    46    50    75.00000  112.20000
   46    44    45    35.00000  117.00000
   46    48    49    37.50000  110.70000
   46    48    51    50.00000  109.50000
   46    50    53    62.00000   98.90000
   48    33    34    37.50000  110.70000
   48    33    38    58.35000  112.70000
   48    46    47    37.50000  110.70000
   48    51    52    55.00000  108.50000
   51    48    49    35.00000  109.50000
   50    46    47    35.00000  109.50000
   50    46    48    75.00000  111.63000
   50    53    54    35.00000  109.50000
   50    53    55    35.00000  109.50000
   50    53    56    75.00000  111.63000
   53    56    57    37.50000  110.70000
   53    56    58    37.50000  110.70000
   53    56    59    70.00000  112.37300
   55    53    54    33.00000  107.80000
   56    53    54    37.50000  110.70000
   56    53    55    37.50000  110.70000
   56    59    60    85.00000  105.04000
   56    59    65    85.00000  105.04000
   56    59    61    58.35000  112.70000
   58    56    57    33.00000  107.80000
   59    56    57    45.00000  109.38400
   59    56    58    45.00000  109.38400
   59    60    65    10.00000   60.00000
   59    65    60    10.00000   60.00000
   59    61    62    45.00000  109.38400
   59    61    63    45.00000  109.38400
   59    61    64    45.00000  109.38400
   65    59    60    10.00000   60.00000
   61    59    60    85.00000  105.04000
   61    59    65    85.00000  105.04000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   42    38    39    35.00000  109.50000
   42    38    40    90.00000  110.39200
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    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   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    39   0.15000  1.0 3.0
   29    33    38    40   0.56750  1.0 1.0
   29    33    38    40  -0.07550 -1.0 2.0
   29    33    38    40   0.20000  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    48    46   0.44750  1.0 1.0
   29    33    48    46  -0.17800 -1.0 2.0
   29    33    48    46   0.20200  1.0 3.0
   29    33    48    49   0.15000  1.0 3.0
   29    33    48    51   0.56750  1.0 1.0
   29    33    48    51  -0.07550 -1.0 2.0
   29    33    48    51   0.20000  1.0 3.0
   33    38    40    41   0.00000  1.0 1.0
   33    38    40    44   0.09850  1.0 1.0
   33    38    40    44   0.15250 -1.0 2.0
   33    38    40    44  -0.50650  1.0 3.0
   33    38    42    43  -0.11600  1.0 1.0
   33    38    42    43  -0.09450 -1.0 2.0
   33    38    42    43   0.21250  1.0 3.0
   33    48    51    52  -0.11600  1.0 1.0
   33    48    51    52  -0.09450 -1.0 2.0
   33    48    51    52   0.21250  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    42   0.23400  1.0 3.0
   34    33    48    46   0.15000  1.0 3.0
   34    33    48    49   0.15000  1.0 3.0
   34    33    48    51   0.23400  1.0 3.0
   38    33    48    46   0.56750  1.0 1.0
   38    33    48    46  -0.07550 -1.0 2.0
   38    33    48    46   0.20000  1.0 3.0
   38    33    48    49   0.15000  1.0 3.0
   38    33    48    51   0.86500  1.0 1.0
   38    33    48    51  -0.17500 -1.0 2.0
   38    33    48    51   0.20800  1.0 3.0
   38    40    44    45   7.00000 -1.0 2.0
   38    40   -44    46   7.00000 -1.0 2.0
   39    38    40    41   0.33100  1.0 3.0
   39    38    40    44   0.00000  1.0 1.0
   39    38    42    43   0.19450  1.0 3.0
   40    38    42    43  -0.07800  1.0 1.0
   40    38    42    43  -0.21500 -1.0 2.0
   40    38    42    43  -0.03150  1.0 3.0
   40    44    46    47   0.00000  1.0 1.0
   40    44    46    48   0.09850  1.0 1.0
   40    44    46    48   0.15250 -1.0 2.0
   40    44    46    48  -0.50650  1.0 3.0
   40    44    46    50   0.42700  1.0 1.0
   40    44    46    50  -0.70350 -1.0 2.0
   40    44    46    50  -0.43150  1.0 3.0
   41    40    44    45   7.00000 -1.0 2.0
   41    40    44    46   7.00000 -1.0 2.0
   44    46   -48    33   0.34400  1.0 1.0
   44    46   -48    33   0.09450 -1.0 2.0
   44    46   -48    33   0.11100  1.0 3.0
   44    46    48    49   0.15000  1.0 3.0
   44    46    48    51   1.05650  1.0 1.0
   44    46    48    51   0.15600 -1.0 2.0
   44    46    48    51   0.53150  1.0 3.0
   44    46    50    53  -0.62250  1.0 1.0
   44    46    50    53  -0.38450 -1.0 2.0
   44    46    50    53   0.81900  1.0 3.0
   45    44    46    47   0.33100  1.0 3.0
   45    44    46    48   0.00000  1.0 1.0
   45    44    46    50   0.00000  1.0 1.0
   46    48    51    52  -0.11600  1.0 1.0
   46    48    51    52  -0.09450 -1.0 2.0
   46    48    51    52   0.21250  1.0 3.0
   46    50    53    54   0.32350  1.0 3.0
   46    50    53    55   0.32350  1.0 3.0
   46    50    53    56   0.01700  1.0 1.0
   46    50    53    56  -0.23550 -1.0 2.0
   46    50    53    56   0.21350  1.0 3.0
   47    46    48    33   0.15000  1.0 3.0
   47    46    48    49   0.15000  1.0 3.0
   47    46    48    51   0.23400  1.0 3.0
   47    46    50    53   0.32350  1.0 3.0
   48    33    38    39   0.15000  1.0 3.0
   48    33   -38    40   0.34400  1.0 1.0
   48    33   -38    40   0.09450 -1.0 2.0
   48    33   -38    40   0.11100  1.0 3.0
   48    33    38    42   0.86500  1.0 1.0
   48    33    38    42  -0.17500 -1.0 2.0
   48    33    38    42   0.20800  1.0 3.0
   48    46    50    53   0.01700  1.0 1.0
   48    46    50    53  -0.23550 -1.0 2.0
   48    46    50    53   0.21350  1.0 3.0
   49    48    51    52   0.19450  1.0 3.0
   50    46    48    33   0.44750  1.0 1.0
   50    46    48    33  -0.17800 -1.0 2.0
   50    46    48    33   0.20200  1.0 3.0
   50    46    48    49   0.15000  1.0 3.0
   50    46    48    51   0.56750  1.0 1.0
   50    46    48    51  -0.07550 -1.0 2.0
   50    46    48    51   0.20000  1.0 3.0
   50    53    56    57   0.15000  1.0 3.0
   50    53    56    58   0.15000  1.0 3.0
   50    53    56    59   0.44750  1.0 1.0
   50    53    56    59  -0.17800 -1.0 2.0
   50    53    56    59   0.20200  1.0 3.0
   53    56    59    60   0.56750  1.0 1.0
   53    56    59    60  -0.07550 -1.0 2.0
   53    56    59    60   0.20000  1.0 3.0
   53    56    59    65   0.56750  1.0 1.0
   53    56    59    65  -0.07550 -1.0 2.0
   53    56    59    65   0.20000  1.0 3.0
   53    56    59    61   0.56750  1.0 1.0
   53    56    59    61  -0.07550 -1.0 2.0
   53    56    59    61   0.20000  1.0 3.0
   54    53    56    57   0.15000  1.0 3.0
   54    53    56    58   0.15000  1.0 3.0
   54    53    56    59   0.15000  1.0 3.0
   55    53    56    57   0.15000  1.0 3.0
   55    53    56    58   0.15000  1.0 3.0
   55    53    56    59   0.15000  1.0 3.0
   56    59   -60    65   0.00000  1.0 1.0
   56    59   -65    60   0.00000  1.0 1.0
   56    59    61    62   0.15000  1.0 3.0
   56    59    61    63   0.15000  1.0 3.0
   56    59    61    64   0.15000  1.0 3.0
   57    56    59    60   0.15000  1.0 3.0
   57    56    59    65   0.15000  1.0 3.0
   57    56    59    61   0.15000  1.0 3.0
   58    56    59    60   0.15000  1.0 3.0
   58    56    59    65   0.15000  1.0 3.0
   58    56    59    61   0.15000  1.0 3.0
   60    59    61    62   0.15000  1.0 3.0
   60    59    61    63   0.15000  1.0 3.0
   60    59    61    64   0.15000  1.0 3.0
   65    59    61    62   0.15000  1.0 3.0
   65    59    61    63   0.15000  1.0 3.0
   65    59    61    64   0.15000  1.0 3.0
   61    59   -60    65   0.00000  1.0 1.0
   61    59   -65    60   0.00000  1.0 1.0
   42    38    40    41   0.00000  1.0 1.0
   42    38    40    44   0.67800  1.0 1.0
   42    38    40    44   0.47050 -1.0 2.0
   42    38    40    44  -0.62500  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   38    41    40    44   1.10000 -1.0 2.0
   46    45    44    40   1.10000 -1.0 2.0
END
