* LIGAND DATABASE FILE (OPLS2005)
*
001      65    66    119    178     345
    1     0 S   NP   _N1_     1    28.74604    94.09779   -21.03547
    2     1 S   H    _HN1     2     1.02834    26.95329   155.27993
    3     1 S   H    _H1_     3     1.02776    90.42080   -73.08529
    4     1 S   H    _H2_     4     1.02969    94.34210    35.33080
    5     1 S   CT   _CA1     5     1.50132   137.57649   162.20984
    6     5 S   HC   _HA1     6     1.09577   105.23488    55.78508
    7     5 S   CO3  _C1_     7     1.53783   112.35093   -64.36583
    8     7 S   O2Z  _O11     8     1.26346   115.00242   -44.06746
    9     7 S   O2Z  _O12     9     1.26241   114.91048   135.05210
   10     5 S   CT   _CB1    10     1.53079   107.39155   173.62108
   11    10 S   HC   HB11    11     1.09817   109.26748   -51.28417
   12    10 S   HC   HB12    12     1.09829   110.41953    65.23372
   13    10 S   CT   _CG1    13     1.53001   112.72460  -172.49776
   14    13 S   HC   HG11    14     1.09597   110.24567   -63.03088
   15    13 S   HC   HG12    15     1.09632   110.18359    56.17075
   16    13 S   C    _CD1    16     1.51819   112.20988   176.32827
   17    16 S   O    _OE1    17     1.22731   123.19257   -11.00528
   18    16 S   N    _N2_    18     1.38598   111.68372   169.65807
   19    18 S   H    _HN2    19     1.01584   119.02135     1.14569
   20    18 S   CT1  _CA2    20     1.46291   123.44193  -177.47470
   21    20 S   HC   _HA2    21     1.09731   109.37337   -14.17648
   22    20 S   C    _C2_    22     1.53398   108.38194  -129.95543
   23    22 S   O    _O2_    23     1.23012   122.27716  -146.29538
   24    20 S   CT   _CB2    32     1.53429   111.16969   107.88466
   25    24 S   HC   HB21    33     1.09596   109.55457    54.78848
   26    24 S   HC   HB22    34     1.09468   110.75439   173.58146
   27    22 S   N    _N3_    24     1.38521   113.33891    41.11319
   28    27 S   H    _HN3    25     1.01532   118.87563    -0.69689
   29    24 S   S    _SG2    35     1.82619   111.54071   -66.51904
   30    27 S   CT   _CA3    26     1.45454   123.50999   175.15892
   31    30 S   HC   HA31    27     1.09519   109.30243    22.97123
   32    30 S   HC   HA32    28     1.09497   107.10045   139.98053
   33    29 S   CT   _C11    36     1.82643    99.20521   156.85470
   34    33 S   HC   _H3_    37     1.09445   106.04588   -53.04469
   35    30 S   CO3  _C3_    29     1.52922   113.09210  -100.55792
   36    35 S   O2Z  _O31    30     1.26404   115.39628   -44.56960
   37    35 S   O2Z  _O32    31     1.26354   114.98918   136.37109
   38    33 S   CM   _C6_    38     1.51679   110.64046  -171.20650
   39    33 S   OS   _O13    51     1.42728   115.40482    61.54865
   40    38 S   CT   _C10    39     1.52055   114.76361   -91.89706
   41    40 S   HC   _H22    40     1.10267   107.60195   128.22312
   42    38 S   CMA  _C7_    59     1.36874   122.89525    87.24424
   43    42 S   OM   _O33    60     1.26937   125.53491   179.76930
   44    40 S   CT   _C8_    41     1.54004   114.99905  -111.56492
   45    44 S   HC   _H19    42     1.09541   112.97500    37.21183
   46    44 S   HC   _H20    43     1.09423   111.39970   -85.93979
   47    42 S   OS   _O16    61     1.41985   111.82106     0.88071
   48    44 S   CM   _C4_    44     1.49438   102.10363   155.89287
   49    48 S   HC   _H18    45     1.08063   123.45564   163.33331
   50    47 S   CT   _C13    62     1.42825   113.51642  -132.80886
   51    50 S   HC   _H25    63     1.09400   107.71393   170.88514
   52    50 S   HC   _H26    64     1.09546   111.12057    52.73227
   53    50 S   HC   _H27    65     1.09465   111.05256   -71.11258
   54    48 S   CM   _C5_    46     1.33967   111.60392   -17.35001
   55    40 S   CT   _C9_    47     1.54420   115.08519     9.94637
   56    55 S   HC   _H21    48     1.09744   109.39274    87.71794
   57    54 S   CT   _C14    54     1.48813   126.64059  -179.21815
   58    57 S   HC   _H28    55     1.09444   110.50769   119.15901
   59    57 S   HC   _H29    56     1.09487   111.43204    -1.45938
   60    55 S   CO   _C12    49     1.53871   114.65306   -37.65095
   61    60 S   HC   _H24    50     1.09664   110.38320  -101.68681
   62    57 S   OH   _O15    57     1.41995   109.26056  -121.16519
   63    62 S   HO   _H31    58     0.97204   107.03706  -178.84140
   64    60 S   OH   _O14    52     1.42758   108.71485   142.68499
   65    64 S   HO   _H30    53     0.97182   106.78465   155.16433
  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
  13   5   2   1   1  15   9  16   9   8   2   9   5   4   4   9
   3   3   2   1   1  10   9   4   5   3   2   3   2   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    40    60    39    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    40    41    44    55    60    61    39    64    42    43    47  
   38    40    60    39    42  
   36    37  
   37  
    0  
   40    41    44    45    46    48    54    55    56    60    39    42    43    47    50  
   64    65    42    40    54    55    56    60    61  
   41    44    45    46    48    49    54    55    56    60    61    64    57    42    43    47  
   44    45    46    48    54    55    56    60    42  
   43    47    50    51    52    53    44    55  
   47    50  
   45    46    48    49    54    55    56    60    57  
   46    48    49    54    55  
   48    49    54    55  
   50    51    52    53  
   49    54    55    56    60    57    58    59    62  
   54    55    57  
   51    52    53  
   52    53  
   53  
    0  
   55    56    60    61    64    57    58    59    62    63  
   56    60    61    64    65    57    58    59    62  
   60    61    64    57  
   58    59    62    63    60  
   59    62    63  
   62    63  
   61    64    65  
   64    65  
   63  
    0  
   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  -0.316400   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   0.387900   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.030000   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   3.5500   0.0760  -0.670200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   48   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660   0.264700   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   62   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   63   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   64   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   317.000  1.510
   33    39   320.000  1.410
   38    40   317.000  1.510
   38    42   465.000  1.376
   40    41   340.000  1.090
   40    44   268.000  1.529
   40    55   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    48   317.000  1.510
   48    49   340.000  1.080
   48    54   549.000  1.340
   54    55   317.000  1.510
   54    57   317.000  1.510
   55    56   340.000  1.090
   55    60   250.000  1.527
   60    61   340.000  1.090
   60    39   320.000  1.380
   60    64   380.000  1.407
   64    65   553.000  0.945
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    62   320.000  1.410
   62    63   553.000  0.945
   42    43   745.000  1.250
   42    47   440.000  1.360
   47    50   320.000  1.410
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   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  112.20000
   29    33    39    85.00000  114.68000
   33    38    40    65.00000  117.92700
   33    38    42    70.00000  124.00000
   33    39    60    60.00000  109.50000
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  109.50000
   38    40    44    70.00000  112.02700
   38    40    55    70.00000  112.02700
   38    42    43    65.00000  137.10300
   38    42    47    80.00000  120.01400
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    48    70.00000  112.02700
   40    55    54    70.00000  112.02700
   40    55    56    37.50000  110.70000
   40    55    60    75.00000  109.43000
   44    40    41    37.50000  110.70000
   44    48    49    35.00000  117.00000
   44    48    54    70.00000  124.00000
   46    44    45    33.00000  107.80000
   48    44    45    35.00000  109.50000
   48    44    46    35.00000  109.50000
   48    54    55    70.00000  124.00000
   48    54    57    70.00000  124.00000
   54    48    49    35.00000  120.00000
   54    55    56    35.00000  109.50000
   54    55    60    70.00000  112.02700
   54    57    58    35.00000  109.50000
   54    57    59    35.00000  109.50000
   54    57    62    90.00000  110.39200
   55    40    41    37.50000  110.70000
   55    40    44    58.35000  112.70000
   55    60    61    45.00000  112.01100
   55    60    39    90.00000  108.56700
   55    60    64    90.00000  110.19100
   60    55    56    45.00000  108.72000
   60    64    65    70.00000  107.92000
   39    33    34    35.00000  109.50000
   39    33    38    85.00000  110.90400
   39    60    61    35.00000  109.50000
   64    60    61    60.00000  108.02500
   64    60    39   110.00000  112.08000
   57    54    55    65.00000  117.92700
   57    62    63    55.00000  108.50000
   59    57    58    33.00000  107.80000
   62    57    58    35.00000  109.50000
   62    57    59    35.00000  109.50000
   42    38    40    70.00000  124.00000
   42    47    50    90.00000  111.18400
   47    42    43    65.00000  121.00000
   47    50    51    35.00000  109.50000
   47    50    52    35.00000  109.50000
   47    50    53    35.00000  109.50000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  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    40   0.30250  1.0 1.0
   29    33    38    40  -0.14950 -1.0 2.0
   29    33    38    40   0.36900  1.0 3.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    39    60   0.14700  1.0 1.0
   29    33    39    60  -1.16150 -1.0 2.0
   29    33    39    60   0.48700  1.0 3.0
   33    38    40    41   0.34800  1.0 3.0
   33    38    40    44   0.46850  1.0 1.0
   33    38    40    44   0.08550 -1.0 2.0
   33    38    40    44   0.09800  1.0 3.0
   33    38    40    55   0.46850  1.0 1.0
   33    38    40    55   0.08550 -1.0 2.0
   33    38    40    55   0.09800  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    47   7.00000 -1.0 2.0
   34    33    38    40   0.34800  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    39    60   0.37050  1.0 3.0
   38    33    39    60  -0.77900  1.0 1.0
   38    33    39    60  -0.36900 -1.0 2.0
   38    33    39    60   0.40400  1.0 3.0
   38    40    44    45   0.15000  1.0 3.0
   38    40    44    46   0.15000  1.0 3.0
   38    40    44    48   0.31000  1.0 1.0
   38    40    44    48   0.14700 -1.0 2.0
   38    40    44    48   0.07550  1.0 3.0
   38    40    55    54   0.31000  1.0 1.0
   38    40    55    54   0.14700 -1.0 2.0
   38    40    55    54   0.07550  1.0 3.0
   38    40    55    56   0.15000  1.0 3.0
   38    40   -55    60   0.34400  1.0 1.0
   38    40   -55    60   0.09450 -1.0 2.0
   38    40   -55    60   0.11100  1.0 3.0
   38    42    47    50  -2.26850  1.0 1.0
   38    42    47    50   3.39050 -1.0 2.0
   40    38    42    43   7.00000 -1.0 2.0
   40    38    42    47   7.00000 -1.0 2.0
   40    44    48    49   0.00000  1.0 1.0
   40    44   -48    54   0.09850  1.0 1.0
   40    44   -48    54   0.15250 -1.0 2.0
   40    44   -48    54  -0.50650  1.0 3.0
   40    55    60    61   0.15000  1.0 3.0
   40    55    60    39   0.62750  1.0 1.0
   40    55    60    39  -0.30950 -1.0 2.0
   40    55    60    39   0.27300  1.0 3.0
   40    55    60    64   0.86500  1.0 1.0
   40    55    60    64  -0.17500 -1.0 2.0
   40    55    60    64   0.20800  1.0 3.0
   41    40    44    45   0.15000  1.0 3.0
   41    40    44    46   0.15000  1.0 3.0
   41    40    44    48   0.15000  1.0 3.0
   41    40    55    54   0.15000  1.0 3.0
   41    40    55    56   0.15000  1.0 3.0
   41    40    55    60   0.15000  1.0 3.0
   44    40   -55    54   0.34400  1.0 1.0
   44    40   -55    54   0.09450 -1.0 2.0
   44    40   -55    54   0.11100  1.0 3.0
   44    40    55    56   0.15000  1.0 3.0
   44    40    55    60   3.97050  1.0 1.0
   44    48   -54    55   7.00000 -1.0 2.0
   44    48    54    57   7.00000 -1.0 2.0
   45    44    48    49   0.33100  1.0 3.0
   45    44    48    54   0.00000  1.0 1.0
   46    44    48    49   0.33100  1.0 3.0
   46    44    48    54   0.00000  1.0 1.0
   48    54   -55    40   0.09850  1.0 1.0
   48    54   -55    40   0.15250 -1.0 2.0
   48    54   -55    40  -0.50650  1.0 3.0
   48    54    55    56   0.00000  1.0 1.0
   48    54    55    60   0.09850  1.0 1.0
   48    54    55    60   0.15250 -1.0 2.0
   48    54    55    60  -0.50650  1.0 3.0
   48    54    57    58   0.00000  1.0 1.0
   48    54    57    59   0.00000  1.0 1.0
   48    54    57    62   0.67800  1.0 1.0
   48    54    57    62   0.47050 -1.0 2.0
   48    54    57    62  -0.62500  1.0 3.0
   49    48    54    55   7.00000 -1.0 2.0
   49    48    54    57   7.00000 -1.0 2.0
   54    55    60    61   0.15000  1.0 3.0
   54    55    60    39   0.61850  1.0 1.0
   54    55    60    39  -0.22750 -1.0 2.0
   54    55    60    39   0.15300  1.0 3.0
   54    55    60    64   1.05650  1.0 1.0
   54    55    60    64   0.15600 -1.0 2.0
   54    55    60    64   0.53150  1.0 3.0
   54    57    62    63  -0.07800  1.0 1.0
   54    57    62    63  -0.21500 -1.0 2.0
   54    57    62    63  -0.03150  1.0 3.0
   55    40    44    45   0.15000  1.0 3.0
   55    40    44    46   0.15000  1.0 3.0
   55    40   -44    48   0.34400  1.0 1.0
   55    40   -44    48   0.09450 -1.0 2.0
   55    40   -44    48   0.11100  1.0 3.0
   55    54    57    58   0.34800  1.0 3.0
   55    54    57    59   0.34800  1.0 3.0
   55    54    57    62   0.18000  1.0 1.0
   55    54    57    62   0.16450 -1.0 2.0
   55    54    57    62   0.04450  1.0 3.0
   55    60   -39    33   0.06250  1.0 1.0
   55    60   -39    33  -0.01100 -1.0 2.0
   55    60   -39    33   0.28050  1.0 3.0
   55    60    64    65  -0.11600  1.0 1.0
   55    60    64    65  -0.09450 -1.0 2.0
   55    60    64    65   0.21250  1.0 3.0
   56    55    60    61   0.15000  1.0 3.0
   56    55    60    39   0.23400  1.0 3.0
   56    55    60    64   0.23400  1.0 3.0
   61    60    39    33   0.37050  1.0 3.0
   61    60    64    65   0.19450  1.0 3.0
   39    33   -38    40   0.09700  1.0 1.0
   39    33   -38    40   0.15600 -1.0 2.0
   39    33   -38    40  -0.50800  1.0 3.0
   39    33    38    42   0.39000  1.0 1.0
   39    33    38    42  -0.05800 -1.0 2.0
   39    33    38    42  -0.55150  1.0 3.0
   39    60    64    65  -0.50000  1.0 1.0
   39    60    64    65  -0.73950 -1.0 2.0
   39    60    64    65   0.17150  1.0 3.0
   64    60    39    33  -0.81800  1.0 1.0
   57    54    55    40   0.46850  1.0 1.0
   57    54    55    40   0.08550 -1.0 2.0
   57    54    55    40   0.09800  1.0 3.0
   57    54    55    56   0.34800  1.0 3.0
   57    54    55    60   0.46850  1.0 1.0
   57    54    55    60   0.08550 -1.0 2.0
   57    54    55    60   0.09800  1.0 3.0
   58    57    62    63   0.19450  1.0 3.0
   59    57    62    63   0.19450  1.0 3.0
   42    38    40    41   0.00000  1.0 1.0
   42    38    40    44   0.09850  1.0 1.0
   42    38    40    44   0.15250 -1.0 2.0
   42    38    40    44  -0.50650  1.0 3.0
   42    38    40    55   0.09850  1.0 1.0
   42    38    40    55   0.15250 -1.0 2.0
   42    38    40    55  -0.50650  1.0 3.0
   42    47    50    51   0.08050  1.0 3.0
   42    47    50    52   0.08050  1.0 3.0
   42    47    50    53   0.08050  1.0 3.0
   43    42    47    50   2.00000 -1.0 2.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    35    36  10.50000 -1.0 2.0
   33    40    38    42   1.10000 -1.0 2.0
   44    49    48    54   1.10000 -1.0 2.0
   55    57    54    48   1.10000 -1.0 2.0
   43    47    42    38   1.10000 -1.0 2.0
END
