* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    133    206     389
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02100   103.67500   -37.78131
    3     1 S   H    _H1_     3     1.02080    70.57177    67.52044
    4     1 S   H    _H2_     4     1.02122    42.77741  -140.62792
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08519   110.61667    58.74867
   26    24 S   HC   HB22    34     1.08547   109.95733   179.14202
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C8_    36     1.84832    97.26050  -178.15019
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CO4  _C9_    37     1.53178   105.47645   -59.97473
   38    37 S   O    _O33    38     1.23019   121.59650   -74.52298
   39    33 S   CM   _C17    49     1.50494   107.95814    61.55489
   40    37 S   CA   _C10    39     1.48525   119.08535   103.56329
   41    39 S   OS   _O34    50     1.38892   116.50459    72.37233
   42    40 S   CA   _C11    40     1.40440   118.22375  -171.27992
   43    42 S   HA   _H10    41     1.08668   121.37349     0.82139
   44    41 S   CT   _C5_    51     1.43973   114.72099    54.54064
   45    42 S   CA   _C12    42     1.39097   120.20673  -179.18675
   46    45 S   HA   _H11    43     1.08588   120.20899  -179.87805
   47    44 S   CT   _C6_    52     1.53828   111.21455   -54.37542
   48    47 S   HC   _H6_    53     1.09696   109.71803   -68.59780
   49    47 S   HC   _H7_    54     1.09647   110.64314   174.32391
   50    44 S   CT   _C4_    58     1.53745   110.08679    70.80834
   51    50 S   HC   _H3_    59     1.08491   109.29980    55.42641
   52    50 S   HC   _H4_    60     1.08562   109.33418   -64.61665
   53    50 S   HC   _H5_    61     1.08519   109.27891   175.45912
   54    44 S   CT   _C19    62     1.53521   105.77863  -172.42490
   55    54 S   HC   _H17    63     1.08625   109.39464   -60.41748
   56    54 S   HC   _H18    64     1.08603   109.36480   179.68973
   57    54 S   HC   _H19    65     1.08581   109.44802    59.58578
   58    45 S   CA   _C13    44     1.38841   119.60265     0.21214
   59    58 S   HA   _H12    45     1.08763   119.53730   179.88986
   60    33 S   CT   _C7_    55     1.53792   110.72688  -177.50982
   61    60 S   HC   _H8_    56     1.09915   109.48874   165.24335
   62    60 S   HC   _H9_    57     1.09809   111.38635    49.38455
   63    58 S   CA   _C14    46     1.39913   120.20626    -0.10835
   64    40 S   CA   _C15    47     1.40609   120.63403     9.32485
   65    63 S   OS   _O36    68     1.36725   116.32626  -179.77358
   66    64 S   CM   _C16    48     1.47569   119.79160     0.12195
   67    65 S   CT   _C18    69     1.42408   116.86331    89.34383
   68    67 S   HC   _H14    70     1.09334   109.48662   180.00000
   69    67 S   HC   _H15    71     1.09325   109.52669    59.22413
   70    67 S   HC   _H16    72     1.09273   109.03331   -60.40540
   71    66 S   OH   _O35    66     1.38500   119.55375   175.88325
   72    71 S   HO   _H13    67     0.96186   109.84259  -180.00000
  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  11   5   4   3
  16   2   1   1  14   5  14  11  16   8   4  15   6   3  13   6
   5   8   3   2   1   4   2   1   1   6   3   3   1   1   8   5
   5   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    60    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    66    39    41    47    60    61    62  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    42    64    66    39    41    44    47    48    49    60    61    62    71  
   35    36  
   36  
    0  
   38    40    42    43    45    63    64    66    39    41    47    60    61    62  
   40    42    64    39    60  
   41    44    47    60    61    62    50    54    71    72    40    63    64    66  
   42    43    45    46    58    63    64    66    60    71    65  
   44    47    48    49    60    50    51    52    53    54    55    56    57    71    64    66  
   43    45    46    58    59    63    64    66  
   45    46    58    64  
   47    48    49    60    61    62    50    51    52    53    54    55    56    57    66  
   46    58    59    63    64    65  
   58    59    63  
   48    49    60    61    62    50    51    52    53    54    55    56    57  
   49    60    61    62    50    54  
   60    61    62    50    54  
   51    52    53    54    55    56    57    60  
   52    53    54  
   53    54  
   54  
   55    56    57    60  
   56    57  
   57  
    0  
   59    63    64    66    65    67  
   63    64    65  
   61    62    66  
   62  
    0  
   64    66    71    65    67    68    69    70  
   66    71    72    65    67  
   67    68    69    70    66  
   71    72  
   68    69    70  
   69    70  
   70  
    0  
   72  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5500   0.0760   0.085000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   41   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   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   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   64   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   65   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   66   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   67   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   71   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.355200   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.522
   33    39   317.000  1.510
   33    60   268.000  1.529
   37    38   570.000  1.229
   37    40   310.000  1.470
   40    42   469.000  1.400
   40    64   469.000  1.400
   42    43   367.000  1.080
   42    45   469.000  1.400
   45    46   367.000  1.080
   45    58   469.000  1.400
   58    59   367.000  1.080
   58    63   469.000  1.400
   63    64   469.000  1.400
   63    65   450.000  1.364
   64    66   320.000  1.460
   66    39   549.000  1.340
   66    71   510.000  1.338
   39    41   440.000  1.360
   41    44   320.000  1.410
   44    47   268.000  1.529
   44    50   268.000  1.529
   44    54   268.000  1.529
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   71    72   553.000  0.945
   65    67   320.000  1.410
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  110.18000
   29    33    39    75.00000  112.20000
   29    33    60    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    40    65.00000  115.47100
   33    39    66    70.00000  124.00000
   33    39    41    85.00000  112.85300
   33    60    47    58.35000  112.70000
   33    60    61    37.50000  110.70000
   33    60    62    37.50000  110.70000
   37    40    42    60.00000  119.52600
   37    40    64    60.00000  119.52600
   40    37    38    75.00000  123.78400
   40    42    43    35.00000  120.00000
   40    42    45    63.00000  120.00000
   40    64    63    63.00000  120.00000
   40    64    66    60.00000  120.93500
   42    45    46    35.00000  120.00000
   42    45    58    63.00000  120.00000
   45    42    43    35.00000  120.00000
   45    58    59    35.00000  120.00000
   45    58    63    63.00000  120.00000
   58    45    46    35.00000  120.00000
   58    63    64    63.00000  120.00000
   58    63    65    70.00000  120.00000
   63    58    59    35.00000  120.00000
   63    64    66    60.00000  120.93500
   63    65    67    75.00000  111.00000
   64    40    42    63.00000  120.00000
   64    66    39    60.00000  123.20500
   64    66    71    85.00000  114.86500
   66    39    41    80.00000  120.01400
   66    71    72    70.00000  107.45700
   39    33    37    70.00000  109.06800
   39    41    44    90.00000  111.18400
   41    44    47    50.00000  109.50000
   41    44    50    50.00000  109.50000
   41    44    54    50.00000  109.50000
   44    47    48    37.50000  110.70000
   44    47    49    37.50000  110.70000
   44    47    60    58.35000  112.70000
   44    50    51    37.50000  110.70000
   44    50    52    37.50000  110.70000
   44    50    53    37.50000  110.70000
   44    54    55    37.50000  110.70000
   44    54    56    37.50000  110.70000
   44    54    57    37.50000  110.70000
   47    60    61    37.50000  110.70000
   47    60    62    37.50000  110.70000
   49    47    48    33.00000  107.80000
   60    33    37    63.00000  111.10000
   60    33    39    70.00000  112.02700
   60    47    48    37.50000  110.70000
   60    47    49    37.50000  110.70000
   62    60    61    33.00000  107.80000
   50    44    47    58.35000  112.70000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    33.00000  107.80000
   54    44    47    58.35000  112.70000
   54    44    50    58.35000  112.70000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   71    66    39    80.00000  121.38400
   65    63    64    70.00000  120.00000
   65    67    68    35.00000  109.50000
   65    67    69    35.00000  109.50000
   65    67    70    35.00000  109.50000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  1.0 3.0
   24    29    33    60   0.01700  1.0 1.0
   24    29    33    60  -0.23550 -1.0 2.0
   24    29    33    60   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    37    38   0.30150 -1.0 2.0
   29    33    37    40   0.65300  1.0 1.0
   29    33    37    40  -0.03850 -1.0 2.0
   29    33    37    40   0.33900  1.0 3.0
   29    33    39    66   0.42700  1.0 1.0
   29    33    39    66  -0.70350 -1.0 2.0
   29    33    39    66  -0.43150  1.0 3.0
   29    33    39    41   0.09700  1.0 1.0
   29    33    39    41   0.15600 -1.0 2.0
   29    33    39    41  -0.50800  1.0 3.0
   29    33    60    47   0.44750  1.0 1.0
   29    33    60    47  -0.17800 -1.0 2.0
   29    33    60    47   0.20200  1.0 3.0
   29    33    60    61   0.15000  1.0 3.0
   29    33    60    62   0.15000  1.0 3.0
   33    37    40    42   2.26350  1.0 1.0
   33    37    40    42   0.76750 -1.0 2.0
   33    37    40    42   0.22500  1.0 3.0
   33    37    40    64   2.26350  1.0 1.0
   33    37    40    64   0.76750 -1.0 2.0
   33    37    40    64   0.22500  1.0 3.0
   33    39    41    44   2.00000 -1.0 2.0
   37    33    39    66  -0.51250  1.0 1.0
   37    33    39    66  -0.88800 -1.0 2.0
   37    33    39    66   0.08850  1.0 3.0
   37    33    39    41   0.09700  1.0 1.0
   37    33    39    41   0.15600 -1.0 2.0
   37    33    39    41  -0.50800  1.0 3.0
   37    33    60    47  -0.95700  1.0 1.0
   37    33    60    47  -0.18200 -1.0 2.0
   37    33    60    47   0.29450  1.0 3.0
   37    33    60    61  -0.11250  1.0 3.0
   37    33    60    62  -0.11250  1.0 3.0
   37    40    42    43   3.62500 -1.0 2.0
   37    40    42    45   3.62500 -1.0 2.0
   37    40    64    63   3.62500 -1.0 2.0
   37    40   -64    66   3.62500 -1.0 2.0
   38    37    40    42   1.05000 -1.0 2.0
   38    37    40    64   1.05000 -1.0 2.0
   40    42    45    46   3.62500 -1.0 2.0
   40    42    45    58   3.62500 -1.0 2.0
   40    64    66    39   0.15800  1.0 1.0
   40    64    66    39   1.85350 -1.0 2.0
   40    64    66    39  -0.48700  1.0 3.0
   40    64    66    71  -0.01750  1.0 1.0
   40    64    66    71  -0.32000 -1.0 2.0
   40    64    66    71   0.00600  1.0 3.0
   42    40    64    63   3.62500 -1.0 2.0
   42    40    64    66   3.62500 -1.0 2.0
   42    45    58    59   3.62500 -1.0 2.0
   42    45   -58    63   3.62500 -1.0 2.0
   43    42    45    46   3.62500 -1.0 2.0
   43    42    45    58   3.62500 -1.0 2.0
   45    58    63    64   3.62500 -1.0 2.0
   45    58    63    65   3.62500 -1.0 2.0
   46    45    58    59   3.62500 -1.0 2.0
   46    45    58    63   3.62500 -1.0 2.0
   58    63   -64    40   3.62500 -1.0 2.0
   58    63    64    66   3.62500 -1.0 2.0
   58    63    65    67   1.63200 -1.0 2.0
   59    58    63    64   3.62500 -1.0 2.0
   59    58    63    65   3.62500 -1.0 2.0
   63    64    66    39   0.15800  1.0 1.0
   63    64    66    39   1.85350 -1.0 2.0
   63    64    66    39  -0.48700  1.0 3.0
   63    64    66    71  -0.01750  1.0 1.0
   63    64    66    71  -0.32000 -1.0 2.0
   63    64    66    71   0.00600  1.0 3.0
   63    65    67    68   0.08050  1.0 3.0
   63    65    67    69   0.08050  1.0 3.0
   63    65    67    70   0.08050  1.0 3.0
   64    40    42    43   3.62500 -1.0 2.0
   64    40   -42    45   3.62500 -1.0 2.0
   64    63    65    67   1.63200 -1.0 2.0
   64    66   -39    33   7.00000 -1.0 2.0
   64    66    39    41   7.00000 -1.0 2.0
   64    66    71    72   2.00000 -1.0 2.0
   66    39    41    44  -2.26850  1.0 1.0
   66    39    41    44   3.39050 -1.0 2.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33   -37    40   0.65300  1.0 1.0
   39    33   -37    40  -0.03850 -1.0 2.0
   39    33   -37    40   0.33900  1.0 3.0
   39    33    60    47   0.34400  1.0 1.0
   39    33    60    47   0.09450 -1.0 2.0
   39    33    60    47   0.11100  1.0 3.0
   39    33    60    61   0.15000  1.0 3.0
   39    33    60    62   0.15000  1.0 3.0
   39    66    71    72  -0.66100  1.0 1.0
   39    66    71    72   1.20850 -1.0 2.0
   39    66    71    72  -0.36000  1.0 3.0
   39    41   -44    47  -0.46850  1.0 1.0
   39    41   -44    47   0.09300 -1.0 2.0
   39    41   -44    47  -0.12850  1.0 3.0
   39    41    44    50  -0.46850  1.0 1.0
   39    41    44    50   0.09300 -1.0 2.0
   39    41    44    50  -0.12850  1.0 3.0
   39    41    44    54  -0.46850  1.0 1.0
   39    41    44    54   0.09300 -1.0 2.0
   39    41    44    54  -0.12850  1.0 3.0
   41    44    47    48   0.23400  1.0 3.0
   41    44    47    49   0.23400  1.0 3.0
   41    44    47    60   0.62750  1.0 1.0
   41    44    47    60  -0.30950 -1.0 2.0
   41    44    47    60   0.27300  1.0 3.0
   41    44    50    51   0.23400  1.0 3.0
   41    44    50    52   0.23400  1.0 3.0
   41    44    50    53   0.23400  1.0 3.0
   41    44    54    55   0.23400  1.0 3.0
   41    44    54    56   0.23400  1.0 3.0
   41    44    54    57   0.23400  1.0 3.0
   44    47   -60    33   0.56750  1.0 1.0
   44    47   -60    33  -0.07550 -1.0 2.0
   44    47   -60    33   0.20000  1.0 3.0
   44    47    60    61   0.15000  1.0 3.0
   44    47    60    62   0.15000  1.0 3.0
   47    44    50    51   0.15000  1.0 3.0
   47    44    50    52   0.15000  1.0 3.0
   47    44    50    53   0.15000  1.0 3.0
   47    44    54    55   0.15000  1.0 3.0
   47    44    54    56   0.15000  1.0 3.0
   47    44    54    57   0.15000  1.0 3.0
   48    47    60    33   0.15000  1.0 3.0
   48    47    60    61   0.15000  1.0 3.0
   48    47    60    62   0.15000  1.0 3.0
   49    47    60    33   0.15000  1.0 3.0
   49    47    60    61   0.15000  1.0 3.0
   49    47    60    62   0.15000  1.0 3.0
   60    33    37    38   0.30150 -1.0 2.0
   60    33    37    40   0.05850 -1.0 2.0
   60    33    37    40   0.17250  1.0 3.0
   60    33    39    66   0.09850  1.0 1.0
   60    33    39    66   0.15250 -1.0 2.0
   60    33    39    66  -0.50650  1.0 3.0
   60    33   -39    41   0.09700  1.0 1.0
   60    33   -39    41   0.15600 -1.0 2.0
   60    33   -39    41  -0.50800  1.0 3.0
   50    44    47    48   0.15000  1.0 3.0
   50    44    47    49   0.15000  1.0 3.0
   50    44    47    60   0.56750  1.0 1.0
   50    44    47    60  -0.07550 -1.0 2.0
   50    44    47    60   0.20000  1.0 3.0
   50    44    54    55   0.15000  1.0 3.0
   50    44    54    56   0.15000  1.0 3.0
   50    44    54    57   0.15000  1.0 3.0
   54    44    47    48   0.15000  1.0 3.0
   54    44    47    49   0.15000  1.0 3.0
   54    44    47    60   0.56750  1.0 1.0
   54    44    47    60  -0.07550 -1.0 2.0
   54    44    47    60   0.20000  1.0 3.0
   54    44    50    51   0.15000  1.0 3.0
   54    44    50    52   0.15000  1.0 3.0
   54    44    50    53   0.15000  1.0 3.0
   71    66    39    33   7.00000 -1.0 2.0
   71    66    39    41   7.00000 -1.0 2.0
   65    63    64    40   3.62500 -1.0 2.0
   65    63    64    66   3.62500 -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
   35    30    34    36  10.50000 -1.0 2.0
   33    40    37    38  10.50000 -1.0 2.0
   42    64    40    37   4.00000 -1.0 2.0
   45    43    42    40   1.10000 -1.0 2.0
   58    46    45    42   1.10000 -1.0 2.0
   63    59    58    45   1.10000 -1.0 2.0
   64    65    63    58   4.00000 -1.0 2.0
   63    66    64    40   4.00000 -1.0 2.0
   64    71    66    39   1.10000 -1.0 2.0
   33    41    39    66   1.10000 -1.0 2.0
END
