* LIGAND DATABASE FILE (OPLS2005)
*
001      63    64    113    176     333
    1     0 S   NP   _N1_     1    29.27667    93.48256   -23.90837
    2     1 S   H    _HN1     2     1.02782   107.38830   -93.22910
    3     1 S   H    _H1_     3     1.02956    89.18403    15.74941
    4     1 S   H    _H2_     4     1.02843    19.52023   172.29123
    5     1 S   CT   _CA1     5     1.50099   126.13833   130.71305
    6     5 S   HC   _HA1     6     1.09570   105.25063    72.86571
    7     5 S   CO3  _C1_     7     1.53787   112.36776   -47.45057
    8     7 S   O2Z  _O11     8     1.26365   114.99288   -44.79717
    9     7 S   O2Z  _O12     9     1.26230   114.91818   134.43768
   10     5 S   CT   _CB1    10     1.53097   107.47624  -169.14181
   11    10 S   HC   HB11    11     1.09827   109.42640   -50.18395
   12    10 S   HC   HB12    12     1.09824   110.41000    66.40231
   13    10 S   CT   _CG1    13     1.53028   112.61678  -171.21732
   14    13 S   HC   HG11    14     1.09591   110.52170   -63.04934
   15    13 S   HC   HG12    15     1.09651   109.94210    56.20925
   16    13 S   C    _CD1    16     1.51780   112.24703   176.66963
   17    16 S   O    _OE1    17     1.22741   123.20657     0.73754
   18    16 S   N    _N2_    18     1.38672   111.69148  -179.43007
   19    18 S   H    _HN2    19     1.01591   119.05010     1.83483
   20    18 S   CT1  _CA2    20     1.46092   123.36779  -179.82417
   21    20 S   HC   _HA2    21     1.09579   109.27117    -3.82725
   22    20 S   C    _C2_    22     1.53464   109.00559  -118.79941
   23    22 S   O    _O2_    23     1.23034   122.04230  -147.93061
   24    20 S   CT   _CB2    32     1.53422   111.72446   118.47358
   25    24 S   HC   HB21    33     1.09667   109.50661    62.81232
   26    24 S   HC   HB22    34     1.09525   110.93068   179.76427
   27    22 S   N    _N3_    24     1.38445   113.52873    39.77397
   28    27 S   H    _HN3    25     1.01492   118.96152    -1.14261
   29    24 S   S    _SG2    35     1.83036   114.92900   -56.78986
   30    27 S   CT   _CA3    26     1.45456   123.58055   174.12714
   31    30 S   HC   HA31    27     1.09511   109.36363    21.95612
   32    30 S   HC   HA32    28     1.09493   107.09828   139.07139
   33    29 S   CT   _C10    36     1.82299   100.68923   -61.72285
   34    33 S   HC   _H5_    37     1.09451   108.53029    61.87487
   35    30 S   CO3  _C3_    29     1.52959   113.02248  -101.53982
   36    35 S   O2Z  _O31    30     1.26414   115.43378   -42.10998
   37    35 S   O2Z  _O32    31     1.26352   114.95234   138.75315
   38    33 S   CT   _C9_    38     1.52188   116.37964   -61.41039
   39    38 S   HC   _H4_    39     1.09479   112.91820    78.61665
   40    38 S   CO   _C8_    40     1.53449   102.27776  -158.85755
   41    40 S   HC   _H3_    41     1.09645   110.82029   137.00894
   42    38 S   OH   _O36    62     1.42743   111.28475   -42.95600
   43    42 S   HO   _H14    63     0.97319   107.40768  -179.57989
   44    40 S   N*   _N4_    42     1.47017   112.31209  -102.06787
   45    40 S   OS   _O34    54     1.44243   107.35207    21.13089
   46    44 S   CNA  _C5_    43     1.37771   120.96943    89.68884
   47    46 S   HC   _H8_    44     1.08324   117.85185     1.90701
   48    33 S   CT   _C11    55     1.52633   112.86985  -178.33188
   49    48 S   HC   _H6_    56     1.09789   112.17697    49.67737
   50    46 S   CM   _C4_    45     1.33165   121.91441  -177.85753
   51    50 S   HC   _H7_    46     1.08143   123.09176   179.87489
   52    48 S   CT   _C12    57     1.52463   114.12126   -76.65492
   53    52 S   HC   _H11    58     1.09366   111.55591    55.31956
   54    52 S   HC   _H12    59     1.09472   111.15262   -67.07436
   55    50 S   CDX  _C7_    47     1.48291   116.45207    -0.15826
   56    52 S   OH   _O35    60     1.42453   109.03280   174.29807
   57    56 S   HO   _H13    61     0.97241   107.03340   179.70993
   58    55 S   NNC  _N5_    48     1.30463   121.87968     0.98913
   59    55 S   NND  _N6_    51     1.37264   118.48621  -179.08700
   60    59 S   H    _H9_    52     1.01370   122.33308    -0.48658
   61    59 S   H    _H10    53     1.01381   120.24589  -179.62991
   62    44 S   C    _C6_    49     1.40985   118.51866   -86.45625
   63    62 S   O    _O33    50     1.23262   121.21791    -0.58047
  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  12   7  14   6   4   1  10   8   8   4   6
   4   7   3   4   3   2   6   1   1   5   3   1   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    48    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    45    48    49    52    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44    45    48    49    52    53    54    56    42    43  
   38    39    40    45    48    49    52    42  
   36    37  
   37  
    0  
   39    40    41    44    46    62    45    48    49    52    42    43  
   40    41    44    45    48    42    43  
   41    44    46    47    50    58    62    63    45    48    49    52    42    43  
   44    46    62    45    48    42  
   43    44    45    48  
    0  
   46    47    50    51    55    58    62    63    45    48  
   48    49    52    53    54    56    46    62  
   47    50    51    55    58    62    63    59  
   50    51    55    62  
   49    52    53    54    56    57  
   52    53    54    56  
   51    55    58    62    59    60    61  
   55    58    59  
   53    54    56    57  
   54    56    57  
   56    57  
   58    62    63    59    60    61  
   57  
    0  
   62    63    59    60    61  
   60    61    62  
   61  
    0  
   63  
    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   3.5000   0.0660   0.480000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0500   0.100000   1.3810   1.2100   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   3.2500   0.1700  -0.560000   1.8100   1.6000   0.054801302  -1.445846770
   45   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   46   3.5000   0.0800   0.100000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0800  -0.060000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0800   0.460000   2.0020   1.7750   0.023028004  -0.852763146
   56   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   57   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   58   3.2500   0.1700  -0.540000   1.8375   1.6250   0.005000000   0.000000000
   59   3.2500   0.1700  -0.790000   1.8650   1.6500   0.051222218  -2.220205820
   60   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
   61   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.7500   0.1050   0.550000   1.9250   1.7000   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.480000   1.5250   1.4250   0.001000000  -1.480495490
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   250.000  1.527
   38    42   320.000  1.410
   40    41   340.000  1.090
   40    44   275.000  1.479
   40    45   320.000  1.380
   44    46   448.000  1.365
   44    62   418.000  1.388
   46    47   367.000  1.080
   46    50   549.000  1.340
   50    51   340.000  1.080
   50    55   427.000  1.433
   55    58   585.000  1.311
   55    59   481.000  1.340
   58    62   457.000  1.358
   62    63   570.000  1.229
   59    60   434.000  1.010
   59    61   434.000  1.010
   45    48   320.000  1.410
   48    49   340.000  1.090
   48    52   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    56   320.000  1.410
   56    57   553.000  0.945
   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    75.00000  109.43000
   33    38    42    50.00000  109.50000
   33    48    45    50.00000  109.50000
   33    48    49    37.50000  110.70000
   33    48    52    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    40    41    45.00000  112.01100
   38    40    44    75.00000  107.44000
   38    40    45    90.00000  108.56700
   38    42    43    55.00000  108.50000
   40    38    39    45.00000  108.72000
   40    44    46    70.00000  121.20000
   40    44    62    70.00000  117.60000
   40    45    48    60.00000  109.50000
   44    40    41    55.00000  103.44000
   44    46    47    35.00000  119.10000
   44    46    50    70.00000  121.20000
   44    62    58    70.00000  118.60000
   44    62    63    80.00000  120.60000
   46    50    51    35.00000  120.00000
   46    50    55    85.00000  117.00000
   50    46    47    35.00000  119.70000
   50    55    58    70.00000  121.02800
   50    55    59    70.00000  120.10000
   55    50    51    35.00000  123.30000
   55    58    62    70.00000  123.15400
   55    59    60    35.00000  120.00000
   55    59    61    35.00000  120.00000
   58    62    63    80.00000  122.50000
   62    44    46    70.00000  121.60000
   59    55    58    70.00000  119.30000
   61    59    60    35.00000  120.00000
   45    40    41    35.00000  109.50000
   45    40    44   105.00000  106.22000
   45    48    49    35.00000  109.50000
   45    48    52    50.00000  109.50000
   48    33    34    37.50000  110.70000
   48    33    38    58.35000  112.70000
   48    52    53    37.50000  110.70000
   48    52    54    37.50000  110.70000
   48    52    56    50.00000  109.50000
   52    48    49    37.50000  110.70000
   52    56    57    55.00000  108.50000
   54    52    53    33.00000  107.80000
   56    52    53    35.00000  109.50000
   56    52    54    35.00000  109.50000
   42    38    39    35.00000  109.50000
   42    38    40    90.00000  111.58700
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   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  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    45   0.56750  1.0 1.0
   29    33    48    45  -0.07550 -1.0 2.0
   29    33    48    45   0.20000  1.0 3.0
   29    33    48    49   0.15000  1.0 3.0
   29    33    48    52   0.44750  1.0 1.0
   29    33    48    52  -0.17800 -1.0 2.0
   29    33    48    52   0.20200  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    44  -0.27100  1.0 1.0
   33    38    40    44  -0.01700 -1.0 2.0
   33    38    40    44  -0.48600  1.0 3.0
   33    38   -40    45   0.62750  1.0 1.0
   33    38   -40    45  -0.30950 -1.0 2.0
   33    38   -40    45   0.27300  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    52    53   0.15000  1.0 3.0
   33    48    52    54   0.15000  1.0 3.0
   33    48    52    56   0.86500  1.0 1.0
   33    48    52    56  -0.17500 -1.0 2.0
   33    48    52    56   0.20800  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    45   0.23400  1.0 3.0
   34    33    48    49   0.15000  1.0 3.0
   34    33    48    52   0.15000  1.0 3.0
   38    33   -48    45   0.62750  1.0 1.0
   38    33   -48    45  -0.30950 -1.0 2.0
   38    33   -48    45   0.27300  1.0 3.0
   38    33    48    49   0.15000  1.0 3.0
   38    33    48    52   0.56750  1.0 1.0
   38    33    48    52  -0.07550 -1.0 2.0
   38    33    48    52   0.20000  1.0 3.0
   38    40    44    46   2.08450  1.0 1.0
   38    40    44    46  -0.39300 -1.0 2.0
   38    40    44    46   0.23400  1.0 3.0
   38    40    44    62  -0.43950  1.0 1.0
   38    40    44    62  -0.08100 -1.0 2.0
   38    40    44    62   0.03350  1.0 3.0
   38    40   -45    48   0.06250  1.0 1.0
   38    40   -45    48  -0.01100 -1.0 2.0
   38    40   -45    48   0.28050  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    44   0.15000  1.0 3.0
   39    38    40    45   0.23400  1.0 3.0
   39    38    42    43   0.19450  1.0 3.0
   40    38    42    43  -0.11600  1.0 1.0
   40    38    42    43  -0.09450 -1.0 2.0
   40    38    42    43   0.21250  1.0 3.0
   40    44    46    47   1.88100 -1.0 2.0
   40    44    46    50  -0.88150  1.0 1.0
   40    44    46    50   2.95600 -1.0 2.0
   40    44    62    58   3.62500 -1.0 2.0
   40    44    62    63   3.04450 -1.0 2.0
   40    45   -48    33   0.06250  1.0 1.0
   40    45   -48    33  -0.01100 -1.0 2.0
   40    45   -48    33   0.28050  1.0 3.0
   40    45    48    49   0.37050  1.0 3.0
   40    45    48    52   0.06250  1.0 1.0
   40    45    48    52  -0.01100 -1.0 2.0
   40    45    48    52   0.28050  1.0 3.0
   41    40    44    46   0.00000  1.0 1.0
   41    40    44    62   0.00000  1.0 1.0
   41    40    45    48   0.37050  1.0 3.0
   44    40    45    48  -2.37750  1.0 1.0
   44    40    45    48  -0.08150 -1.0 2.0
   44    40    45    48   0.59000  1.0 3.0
   44    46    50    51   0.97550 -1.0 2.0
   44    46    50    55   7.00000 -1.0 2.0
   46    44    62    58   3.62500 -1.0 2.0
   46    44    62    63   2.67200 -1.0 2.0
   46    50   -55    58   7.00000 -1.0 2.0
   46    50    55    59   7.00000 -1.0 2.0
   47    46    50    51   7.00000 -1.0 2.0
   47    46    50    55   7.00000 -1.0 2.0
   50    55    58    62   3.62500 -1.0 2.0
   50    55    59    60   0.70000 -1.0 2.0
   50    55    59    61   0.70000 -1.0 2.0
   51    50    55    58   7.00000 -1.0 2.0
   51    50    55    59   7.00000 -1.0 2.0
   55    58   -62    44   3.62500 -1.0 2.0
   55    58    62    63   3.04450 -1.0 2.0
   58    55    59    60   0.70000 -1.0 2.0
   58    55    59    61   0.70000 -1.0 2.0
   62    44    46    47   1.44600  1.0 1.0
   62    44   -46    50  -0.18900  1.0 1.0
   62    44   -46    50   1.70900 -1.0 2.0
   59    55    58    62   3.62500 -1.0 2.0
   45    40    44    46  -0.28000  1.0 1.0
   45    40    44    46  -1.16550 -1.0 2.0
   45    40    44    62  -2.75650  1.0 1.0
   45    40    44    62  -1.18150 -1.0 2.0
   45    40    44    62   0.81900  1.0 3.0
   45    48    52    53   0.23400  1.0 3.0
   45    48    52    54   0.23400  1.0 3.0
   45    48    52    56   3.69350  1.0 1.0
   45    48    52    56  -1.82950 -1.0 2.0
   48    33    38    39   0.15000  1.0 3.0
   48    33   -38    40   3.97050  1.0 1.0
   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    52    56    57  -0.11600  1.0 1.0
   48    52    56    57  -0.09450 -1.0 2.0
   48    52    56    57   0.21250  1.0 3.0
   49    48    52    53   0.15000  1.0 3.0
   49    48    52    54   0.15000  1.0 3.0
   49    48    52    56   0.23400  1.0 3.0
   53    52    56    57   0.19450  1.0 3.0
   54    52    56    57   0.19450  1.0 3.0
   42    38    40    41   0.23400  1.0 3.0
   42    38    40    44   2.76900  1.0 1.0
   42    38    40    44  -0.24350 -1.0 2.0
   42    38    40    44  -0.78250  1.0 3.0
   42    38    40    45   3.69350  1.0 1.0
   42    38    40    45  -1.82950 -1.0 2.0
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
   46    62    44    40   1.00000 -1.0 2.0
   44    47    46    50   1.10000 -1.0 2.0
   55    51    50    46   1.10000 -1.0 2.0
   59    50    55    58  10.50000 -1.0 2.0
   44    58    62    63  10.50000 -1.0 2.0
   61    55    59    60   1.00000 -1.0 2.0
END
