* LIGAND DATABASE FILE (OPLS2005)
*
001      63    66    116    194     344
    1     0 S   NP   _N1_     1    28.82710    95.96849   -22.90940
    2     1 S   H    _HN1     2     1.02949    74.75594     9.58298
    3     1 S   H    _H1_     3     1.02828    36.54626   161.08592
    4     1 S   H    _H2_     4     1.02789   102.93194   -96.23303
    5     1 S   CT   _CA1     5     1.50118   139.71518   113.31587
    6     5 S   HC   _HA1     6     1.09574   105.18206    87.36809
    7     5 S   CO3  _C1_     7     1.53784   112.46482   -32.85106
    8     7 S   O2Z  _O11     8     1.26374   115.00845   -42.43798
    9     7 S   O2Z  _O12     9     1.26240   114.94262   136.64849
   10     5 S   CT   _CB1    10     1.53072   107.41336  -154.65945
   11    10 S   HC   HB11    11     1.09835   109.35381   -49.62770
   12    10 S   HC   HB12    12     1.09813   110.45547    66.97454
   13    10 S   CT   _CG1    13     1.52996   112.62072  -170.59820
   14    13 S   HC   HG11    14     1.09580   110.65263   -66.13301
   15    13 S   HC   HG12    15     1.09671   109.76825    53.10681
   16    13 S   C    _CD1    16     1.51805   112.17219   173.55339
   17    16 S   O    _OE1    17     1.22736   123.26687     8.06261
   18    16 S   N    _N2_    18     1.38649   111.70677  -171.99058
   19    18 S   H    _HN2    19     1.01579   118.93522     1.61058
   20    18 S   CT1  _CA2    20     1.46212   123.40057   177.35188
   21    20 S   HC   _HA2    21     1.09734   109.37072     4.44409
   22    20 S   C    _C2_    22     1.53587   108.63009  -111.09974
   23    22 S   O    _O2_    23     1.23069   122.26386  -147.62818
   24    20 S   CT   _CB2    32     1.53362   111.59329   126.50310
   25    24 S   HC   HB21    33     1.09439   109.69453    56.48321
   26    24 S   HC   HB22    34     1.09501   110.08707   175.54865
   27    22 S   N    _N3_    24     1.38320   113.75418    39.76963
   28    27 S   H    _HN3    25     1.01573   119.59800    -3.15169
   29    24 S   S    _SG2    35     1.82626   111.46907   -64.44590
   30    27 S   CT   _CA3    26     1.45288   123.23764   177.22265
   31    30 S   HC   HA31    27     1.09549   107.50133   -64.97122
   32    30 S   HC   HA32    28     1.09555   108.00124    51.47759
   33    29 S   CT   _C18    36     1.85742   100.12883  -172.64737
   34    33 S   HC   _H3_    37     1.09634   107.48847    40.71267
   35    30 S   CO3  _C3_    29     1.52967   114.06641   173.48479
   36    35 S   O2Z  _O31    30     1.26378   116.06965    -0.51129
   37    35 S   O2Z  _O32    31     1.26426   114.41514   179.54933
   38    33 S   CA   _C13    38     1.51493   109.94037   -80.47666
   39    38 S   CA   _C8_    39     1.39737   121.59809    90.69797
   40    39 S   HA   _H23    40     1.08712   120.47198     3.83001
   41    38 S   CR3  _C12    52     1.40723   119.33884   -86.46975
   42    39 S   CA   _C6_    41     1.39731   120.41590  -175.24239
   43    42 S   HA   _H21    42     1.08831   118.64940   179.58504
   44    41 S   CM   _C17    53     1.48594   121.19820    -7.33283
   45    42 S   CA   _C9_    43     1.40461   120.97827     0.80697
   46    44 S   CM   _C15    54     1.45443   119.51926   172.36133
   47    46 S   HC   _H25    55     1.08543   119.15723  -175.41871
   48    44 S   CM   _C16    58     1.34626   118.46010   -12.12085
   49    48 S   HC   _H26    59     1.08697   120.23992  -176.29646
   50    45 S   CA   _C5_    44     1.40363   121.62188   178.41588
   51    50 S   HA   _H20    45     1.08808   120.48224     0.42567
   52    62 S   CM   _C14    56     1.47567   120.21059   178.95320
   53    52 S   HC   _H24    57     1.08468   118.63903    -2.02806
   54    33 S   CT   _C19    60     1.54883   110.70473   158.25693
   55    54 S   HC   _H28    61     1.09852   108.49623  -165.40770
   56    50 S   CA   _C4_    46     1.39585   120.75371  -179.27611
   57    56 S   HA   _H19    47     1.08657   119.82651   179.79729
   58    54 S   OH   _O17    62     1.42531   110.86826   -49.25129
   59    58 S   HO   _H29    63     0.97224   107.87313  -178.01101
   60    56 S   CA   _C7_    48     1.39368   120.29983     0.14402
   61    60 S   HA   _H22    49     1.08718   119.10382   179.46808
   62    60 S   CA   _C11    50     1.39830   120.05934    -0.40494
   63    45 S   CR3  _C10    51     1.41260   119.26739    -1.41513
  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   9   5   4   3
  14   7   2   1   1  14   9   4  13   7   3  12   8   9   4   7
   3   7   4   6   3   3   2   5   3   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    54    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    48    54    55    58  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    42    63    41    44    48    49    54    55    58    59  
   38    39    41    48    54    55    58  
   36    37  
   37  
    0  
   39    40    42    43    45    62    63    41    44    46    48    54    55    58  
   40    42    43    45    50    63    41    44    54  
   42    43    45    41  
   44    46    47    52    48    49    54    42    45    50    60    62    63  
   43    45    50    51    56    62    63  
   45    50    63  
   46    47    52    53    48    49    54    55    58    45    62    63  
   50    51    56    57    60    62    63    52  
   47    52    53    48    49    54    60    62    63  
   52    53    48    62  
   49    54    55    58    59    52    63  
   54    55    58  
   51    56    57    60    61    62    63  
   56    57    60    63  
   53    56    60    61    62    63  
   60    62    63  
   55    58    59  
   58    59  
   57    60    61    62    63  
   60    61    62  
   59  
    0  
   61    62    63  
   62    63  
   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   0.222500   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   40   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   41   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   44   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   45   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   63   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
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    54   268.000  1.529
   38    39   469.000  1.400
   38    41   490.000  1.398
   39    40   367.000  1.080
   39    42   469.000  1.400
   42    43   367.000  1.080
   42    45   469.000  1.400
   45    50   469.000  1.400
   45    63   490.000  1.398
   50    51   367.000  1.080
   50    56   469.000  1.400
   56    57   367.000  1.080
   56    60   469.000  1.400
   60    61   367.000  1.080
   60    62   469.000  1.400
   62    63   490.000  1.398
   62    52   320.000  1.460
   63    41   490.000  1.398
   41    44   320.000  1.460
   44    46   380.000  1.444
   44    48   549.000  1.340
   46    47   340.000  1.080
   46    52   549.000  1.340
   52    53   340.000  1.080
   48    49   340.000  1.080
   48    54   317.000  1.510
   54    55   340.000  1.090
   54    58   320.000  1.410
   58    59   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    80.00000  109.48900
   29    33    54    75.00000  111.63000
   33    38    39    70.00000  120.00000
   33    38    41    80.00000  105.07000
   33    54    48    70.00000  112.02700
   33    54    55    37.50000  110.70000
   33    54    58    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    39    40    35.00000  120.00000
   38    39    42    63.00000  120.00000
   38    41    63    60.00000  130.80000
   38    41    44    60.00000  120.93500
   39    42    43    35.00000  120.00000
   39    42    45    63.00000  120.00000
   42    39    40    35.00000  120.00000
   42    45    50    63.00000  120.00000
   42    45    63    70.00000  112.88000
   45    42    43    35.00000  120.00000
   45    50    51    35.00000  120.00000
   45    50    56    63.00000  120.00000
   45    63    62    60.00000  130.80000
   45    63    41    60.00000  130.80000
   50    56    57    35.00000  120.00000
   50    56    60    63.00000  120.00000
   56    50    51    35.00000  120.00000
   56    60    61    35.00000  120.00000
   56    60    62    63.00000  120.00000
   60    56    57    35.00000  120.00000
   60    62    63    70.00000  112.88000
   60    62    52    60.00000  120.93500
   62    60    61    35.00000  120.00000
   62    63    41    60.00000  130.80000
   62    52    46    60.00000  123.20500
   62    52    53    40.00000  117.26300
   63    45    50    70.00000  112.88000
   63    41    44    60.00000  120.93500
   41    38    39    70.00000  112.88000
   41    44    46    60.00000  123.20500
   41    44    48    60.00000  123.20500
   44    46    47    35.00000  120.00000
   44    46    52    70.00000  123.01800
   44    48    49    35.00000  120.00000
   44    48    54    70.00000  124.00000
   46    52    53    35.00000  120.00000
   52    62    63    60.00000  120.93500
   52    46    47    35.00000  120.00000
   48    44    46    70.00000  123.01800
   48    54    55    35.00000  109.50000
   48    54    58    90.00000  110.39200
   54    33    34    37.50000  110.70000
   54    33    38    70.00000  112.17500
   54    48    49    35.00000  117.00000
   54    58    59    55.00000  108.50000
   58    54    55    35.00000  109.50000
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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    54   0.01700  1.0 1.0
   24    29    33    54  -0.23550 -1.0 2.0
   24    29    33    54   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  -0.16000  1.0 1.0
   29    33    38    39  -0.03200 -1.0 2.0
   29    33    38    39   0.04500  1.0 3.0
   29    33    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    54    48   0.56750  1.0 1.0
   29    33    54    48  -0.07550 -1.0 2.0
   29    33    54    48   0.20000  1.0 3.0
   29    33    54    55   0.15000  1.0 3.0
   29    33    54    58   0.56750  1.0 1.0
   29    33    54    58  -0.07550 -1.0 2.0
   29    33    54    58   0.20000  1.0 3.0
   33    38    39    40   3.62500 -1.0 2.0
   33    38    39    42   3.62500 -1.0 2.0
   33    38    41    63   3.62500 -1.0 2.0
   33    38    41    44   3.62500 -1.0 2.0
   33    54    58    59  -0.11600  1.0 1.0
   33    54    58    59  -0.09450 -1.0 2.0
   33    54    58    59   0.21250  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    54    48   0.15000  1.0 3.0
   34    33    54    55   0.15000  1.0 3.0
   34    33    54    58   0.23400  1.0 3.0
   38    33    54    48   0.21200  1.0 1.0
   38    33    54    48   0.16900 -1.0 2.0
   38    33    54    48  -1.15100  1.0 3.0
   38    33    54    55   0.43200  1.0 3.0
   38    33    54    58   1.13150  1.0 1.0
   38    33    54    58  -1.01400 -1.0 2.0
   38    39    42    43   3.62500 -1.0 2.0
   38    39    42    45   3.62500 -1.0 2.0
   38    41    44    46   0.15800  1.0 1.0
   38    41    44    46   1.85350 -1.0 2.0
   38    41    44    46  -0.48700  1.0 3.0
   38    41   -44    48   0.15800  1.0 1.0
   38    41   -44    48   1.85350 -1.0 2.0
   38    41   -44    48  -0.48700  1.0 3.0
   39    38    41    63   3.62500 -1.0 2.0
   39    38    41    44   3.62500 -1.0 2.0
   39    42    45    50   3.62500 -1.0 2.0
   39    42   -45    63   3.62500 -1.0 2.0
   40    39    42    43   3.62500 -1.0 2.0
   40    39    42    45   3.62500 -1.0 2.0
   42    45    50    51   3.62500 -1.0 2.0
   42    45    50    56   3.62500 -1.0 2.0
   42    45    63    62   3.62500 -1.0 2.0
   42    45    63    41   3.62500 -1.0 2.0
   43    42    45    50   3.62500 -1.0 2.0
   43    42    45    63   3.62500 -1.0 2.0
   45    50    56    57   3.62500 -1.0 2.0
   45    50    56    60   3.62500 -1.0 2.0
   45    63   -41    38   3.62500 -1.0 2.0
   45    63    41    44   3.62500 -1.0 2.0
   50    45    63    62   3.62500 -1.0 2.0
   50    45    63    41   3.62500 -1.0 2.0
   50    56    60    61   3.62500 -1.0 2.0
   50    56   -60    62   3.62500 -1.0 2.0
   51    50    56    57   3.62500 -1.0 2.0
   51    50    56    60   3.62500 -1.0 2.0
   56    60    62    63   3.62500 -1.0 2.0
   56    60    62    52   3.62500 -1.0 2.0
   57    56    60    61   3.62500 -1.0 2.0
   57    56    60    62   3.62500 -1.0 2.0
   60    62   -63    45   3.62500 -1.0 2.0
   60    62    63    41   3.62500 -1.0 2.0
   60    62    52    46   0.15800  1.0 1.0
   60    62    52    46   1.85350 -1.0 2.0
   60    62    52    46  -0.48700  1.0 3.0
   60    62    52    53   0.56550  1.0 3.0
   61    60    62    63   3.62500 -1.0 2.0
   61    60    62    52   3.62500 -1.0 2.0
   62    63    41    38   3.62500 -1.0 2.0
   62    63    41    44   3.62500 -1.0 2.0
   63    45    50    51   3.62500 -1.0 2.0
   63    45   -50    56   3.62500 -1.0 2.0
   63    62    52    46   0.15800  1.0 1.0
   63    62    52    46   1.85350 -1.0 2.0
   63    62    52    46  -0.48700  1.0 3.0
   63    62    52    53   0.56550  1.0 3.0
   63    41   -44    46   0.15800  1.0 1.0
   63    41   -44    46   1.85350 -1.0 2.0
   63    41   -44    46  -0.48700  1.0 3.0
   63    41    44    48   0.15800  1.0 1.0
   63    41    44    48   1.85350 -1.0 2.0
   63    41    44    48  -0.48700  1.0 3.0
   41    38    39    40   3.62500 -1.0 2.0
   41    38   -39    42   3.62500 -1.0 2.0
   41    44    46    47   0.00000  1.0 1.0
   41    44    46    52  -0.18600  1.0 3.0
   41    44    48    49   7.00000 -1.0 2.0
   41    44    48    54   7.00000 -1.0 2.0
   44    46   -52    62   7.00000 -1.0 2.0
   44    46    52    53   7.00000 -1.0 2.0
   44    48   -54    33   0.09850  1.0 1.0
   44    48   -54    33   0.15250 -1.0 2.0
   44    48   -54    33  -0.50650  1.0 3.0
   44    48    54    55   0.00000  1.0 1.0
   44    48    54    58   0.67800  1.0 1.0
   44    48    54    58   0.47050 -1.0 2.0
   44    48    54    58  -0.62500  1.0 3.0
   46    44    48    49   7.00000 -1.0 2.0
   46    44    48    54   7.00000 -1.0 2.0
   47    46    52    62   7.00000 -1.0 2.0
   47    46    52    53   7.00000 -1.0 2.0
   52    62    63    45   3.62500 -1.0 2.0
   52    62   -63    41   3.62500 -1.0 2.0
   48    44    46    47  -0.18600  1.0 3.0
   48    44    46    52   0.28850  1.0 1.0
   48    44    46    52   2.61350 -1.0 2.0
   48    44    46    52   0.78400  1.0 3.0
   48    54    58    59  -0.07800  1.0 1.0
   48    54    58    59  -0.21500 -1.0 2.0
   48    54    58    59  -0.03150  1.0 3.0
   49    48    54    33   0.00000  1.0 1.0
   49    48    54    55   0.33100  1.0 3.0
   49    48    54    58   0.00000  1.0 1.0
   54    33    38    39   0.04150 -1.0 2.0
   54    33   -38    41   0.04150 -1.0 2.0
   55    54    58    59   0.19450  1.0 3.0
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
   39    41    38    33   4.00000 -1.0 2.0
   42    40    39    38   1.10000 -1.0 2.0
   45    43    42    39   1.10000 -1.0 2.0
   50    63    45    42   4.00000 -1.0 2.0
   56    51    50    45   1.10000 -1.0 2.0
   60    57    56    50   1.10000 -1.0 2.0
   62    61    60    56   1.10000 -1.0 2.0
   63    52    62    60   4.00000 -1.0 2.0
   62    41    63    45   4.00000 -1.0 2.0
   63    44    41    38   4.00000 -1.0 2.0
   41    46    44    48   1.10000 -1.0 2.0
   44    47    46    52   1.10000 -1.0 2.0
   62    53    52    46   1.10000 -1.0 2.0
   54    49    48    44   1.10000 -1.0 2.0
END
