* LIGAND DATABASE FILE (OPLS2005)
*
001      66    68    118    194     351
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02037    40.81195   116.93702
    3     1 S   H    _H1_     3     1.02160    73.04073   -93.11279
    4     1 S   H    _H2_     4     1.02082   102.63671    12.84455
    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     1.04690   118.93088     8.54895
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08448   106.42696   -11.15906
   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     1.08733   110.25787    59.09629
   26    24 S   HC   HB22    34     1.08755   109.66015   178.71915
   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   _C13    36     1.80604    98.14668  -178.23764
   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   CM   _C14    37     1.50944   107.62541    60.00565
   38    37 S   HC   _H9_    38     1.08891   117.88221    61.69394
   39    33 S   CT   _C12    47     1.53302   108.79432   178.98067
   40    39 S   HC   _H4_    48     1.09026   108.95374    62.42052
   41    37 S   CM   _C15    39     1.33788   124.23239  -119.03885
   42    41 S   HC   _H10    40     1.08354   121.37870  -179.65850
   43    39 S   CT   _C11    49     1.51641   111.47436  -175.92604
   44    43 S   HC   _H3_    50     1.09523   111.73960   -37.57632
   45    39 S   OH   _O35    65     1.42087   108.68323   -54.94362
   46    45 S   HO   _H8_    66     0.97114   106.84904   177.91250
   47    41 S   CO4  _C16    41     1.47992   120.49719     0.25944
   48    47 S   O    _O36    42     1.22688   121.04777   179.77794
   49    43 S   CO4  _C10    51     1.50943   111.99066  -160.92015
   50    49 S   O    _O33    52     1.21461   127.83481    57.82797
   51    43 S   OS   _O34    62     1.44996   109.51721    82.19336
   52    47 S   CM   _C17    43     1.47854   117.92747    -0.28667
   53    52 S   HC   _H11    44     1.08448   118.06767  -179.58978
   54    49 S   CA   _C8_    53     1.43876   106.95447  -122.10638
   55    33 S   CM   _C18    45     1.50931   107.96056   -61.78107
   56    55 S   HC   _H12    46     1.08868   117.91614   -61.88077
   57    54 S   CA   _C9_    54     1.37910   131.00092  -178.65433
   58    57 S   HA   _H7_    55     1.08308   122.03875     0.39017
   59    57 S   CA   _C4_    56     1.39540   116.88976  -179.63096
   60    59 S   HA   _H5_    57     1.08715   119.48595  -179.96574
   61    59 S   CA   _C5_    58     1.40744   120.64478     0.09279
   62    61 S   CA   _C6_    59     1.39914   120.82970     0.00000
   63    62 S   HA   _H6_    60     1.08408   120.98179   179.89721
   64    61 S   OH   _O37    63     1.36265   119.50993   179.97202
   65    64 S   HO   _H13    64     0.96961   110.21217    -0.00000
   66    54 S   CA   _C7_    61     1.37961   105.76638     1.79035
  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
  17   2   1   1  12   5  14   7   6   3  11   6   4   1   5   3
   8   4   6   3   2   8   1   1   7   4   7   3   5   4   2   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    55    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    52    55    56    39    40    43    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    47    52    53    55    56    39    40    43    44    49    51    45    46  
   35    36  
   36  
    0  
   38    41    42    47    48    52    55    56    39    40    43    45  
   41    42    47    55    39  
   40    43    44    49    50    54    66    51    45    46    41    52    55    56  
   43    44    49    51    45    46    55  
   42    47    48    52    53    55  
   47    48    52  
   44    49    50    54    57    62    66    51    45    46    55  
   49    50    54    66    51    45  
   46    49    51    55  
    0  
   48    52    53    55    56  
   52    53    55  
   50    54    57    58    59    62    66    51  
   54    57    66    51  
   54    57    61    62    63    66  
   53    55    56  
   55    56  
   57    58    59    60    61    62    63    66  
   56  
    0  
   58    59    60    61    62    66    64  
   59    60    61    66  
   60    61    62    63    66    64    65  
   61    62    64  
   62    63    66    64    65  
   63    66    64    65  
   66    64  
   65    66  
    0  
    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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.218000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   45   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   46   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   47   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   49   3.7500   0.1050   0.537000   2.1120   1.8750   0.001000000  -0.126889456
   50   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   51   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5500   0.0700   0.085000   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    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  1.510
   33    55   317.000  1.510
   33    39   268.000  1.529
   37    38   340.000  1.080
   37    41   549.000  1.340
   41    42   340.000  1.080
   41    47   320.000  1.462
   47    48   570.000  1.229
   47    52   320.000  1.462
   52    53   340.000  1.080
   52    55   549.000  1.340
   55    56   340.000  1.080
   39    40   340.000  1.090
   39    43   268.000  1.529
   39    45   320.000  1.410
   43    44   340.000  1.090
   43    49   317.000  1.522
   43    51   320.000  1.410
   49    50   570.000  1.229
   49    54   310.000  1.470
   54    57   469.000  1.400
   54    66   469.000  1.400
   57    58   367.000  1.080
   57    59   469.000  1.400
   59    60   367.000  1.080
   59    61   469.000  1.400
   61    62   469.000  1.400
   61    64   450.000  1.364
   62    63   367.000  1.080
   62    66   469.000  1.400
   66    51   450.000  1.364
   64    65   553.000  0.945
   45    46   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    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  112.20000
   29    33    55    75.00000  112.20000
   29    33    39    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    55    52    70.00000  124.00000
   33    55    56    35.00000  117.00000
   33    39    40    37.50000  110.70000
   33    39    43    58.35000  112.70000
   33    39    45    50.00000  109.50000
   37    41    42    35.00000  120.00000
   37    41    47    65.00000  118.96000
   41    37    38    35.00000  120.00000
   41    47    48    80.00000  123.72100
   41    47    52    65.00000  118.65900
   47    41    42    40.00000  117.72500
   47    52    53    40.00000  117.72500
   47    52    55    65.00000  118.96000
   52    47    48    80.00000  123.72100
   52    55    56    35.00000  120.00000
   55    33    37    70.00000  110.12100
   55    52    53    35.00000  120.00000
   39    33    37    70.00000  112.02700
   39    33    55    70.00000  112.02700
   39    43    44    37.50000  110.70000
   39    43    49    63.00000  111.10000
   39    43    51    50.00000  109.50000
   39    45    46    55.00000  108.50000
   43    39    40    37.50000  110.70000
   43    49    50    80.00000  120.40000
   43    49    54    65.00000  115.47100
   43    51    66    75.00000  111.00000
   49    43    44    35.00000  109.50000
   49    54    57    60.00000  119.52600
   49    54    66    60.00000  119.52600
   54    49    50    75.00000  123.78400
   54    57    58    35.00000  120.00000
   54    57    59    63.00000  120.00000
   54    66    62    63.00000  120.00000
   54    66    51    70.00000  120.00000
   57    59    60    35.00000  120.00000
   57    59    61    63.00000  120.00000
   59    57    58    35.00000  120.00000
   59    61    62    63.00000  120.00000
   59    61    64    70.00000  120.00000
   61    59    60    35.00000  120.00000
   61    62    63    35.00000  120.00000
   61    62    66    63.00000  120.00000
   61    64    65    35.00000  113.00000
   62    66    51    70.00000  120.00000
   66    54    57    63.00000  120.00000
   66    62    63    35.00000  120.00000
   51    43    44    35.00000  109.50000
   51    43    49    90.00000  108.74100
   64    61    62    70.00000  120.00000
   45    39    40    35.00000  109.50000
   45    39    43    50.00000  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    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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    55  -0.62250  1.0 1.0
   24    29    33    55  -0.38450 -1.0 2.0
   24    29    33    55   0.81900  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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   0.00000  1.0 1.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    55    52   0.42700  1.0 1.0
   29    33    55    52  -0.70350 -1.0 2.0
   29    33    55    52  -0.43150  1.0 3.0
   29    33    55    56   0.00000  1.0 1.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.44750  1.0 1.0
   29    33    39    43  -0.17800 -1.0 2.0
   29    33    39    43   0.20200  1.0 3.0
   29    33    39    45   0.56750  1.0 1.0
   29    33    39    45  -0.07550 -1.0 2.0
   29    33    39    45   0.20000  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    47   7.00000 -1.0 2.0
   33    39    43    44   0.15000  1.0 3.0
   33    39    43    49  -0.95700  1.0 1.0
   33    39    43    49  -0.18200 -1.0 2.0
   33    39    43    49   0.29450  1.0 3.0
   33    39    43    51   0.62750  1.0 1.0
   33    39    43    51  -0.30950 -1.0 2.0
   33    39    43    51   0.27300  1.0 3.0
   33    39    45    46  -0.11600  1.0 1.0
   33    39    45    46  -0.09450 -1.0 2.0
   33    39    45    46   0.21250  1.0 3.0
   37    33    55    52  -0.28300  1.0 1.0
   37    33    55    52   0.26700 -1.0 2.0
   37    33    55    52  -0.63300  1.0 3.0
   37    33    55    56   0.00000  1.0 1.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    43   0.34400  1.0 1.0
   37    33    39    43   0.09450 -1.0 2.0
   37    33    39    43   0.11100  1.0 3.0
   37    33    39    45   1.05650  1.0 1.0
   37    33    39    45   0.15600 -1.0 2.0
   37    33    39    45   0.53150  1.0 3.0
   37    41    47    48   1.00000 -1.0 2.0
   37    41   -47    52  -1.18350  1.0 1.0
   37    41   -47    52   1.45950 -1.0 2.0
   38    37    41    42   7.00000 -1.0 2.0
   38    37    41    47   7.00000 -1.0 2.0
   41    47    52    53   0.93700 -1.0 2.0
   41    47    52    55  -1.18350  1.0 1.0
   41    47    52    55   1.45950 -1.0 2.0
   42    41    47    48   0.00000  1.0 1.0
   42    41    47    52   0.93700 -1.0 2.0
   47    52   -55    33   7.00000 -1.0 2.0
   47    52    55    56   7.00000 -1.0 2.0
   48    47    52    53   0.00000  1.0 1.0
   48    47    52    55   1.00000 -1.0 2.0
   53    52    55    33   7.00000 -1.0 2.0
   53    52    55    56   7.00000 -1.0 2.0
   55    33    37    38   0.00000  1.0 1.0
   55    33   -37    41  -0.28300  1.0 1.0
   55    33   -37    41   0.26700 -1.0 2.0
   55    33   -37    41  -0.63300  1.0 3.0
   55    33    39    40   0.15000  1.0 3.0
   55    33    39    43   0.34400  1.0 1.0
   55    33    39    43   0.09450 -1.0 2.0
   55    33    39    43   0.11100  1.0 3.0
   55    33    39    45   1.05650  1.0 1.0
   55    33    39    45   0.15600 -1.0 2.0
   55    33    39    45   0.53150  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    41   0.09850  1.0 1.0
   39    33    37    41   0.15250 -1.0 2.0
   39    33    37    41  -0.50650  1.0 3.0
   39    33    55    52   0.09850  1.0 1.0
   39    33    55    52   0.15250 -1.0 2.0
   39    33    55    52  -0.50650  1.0 3.0
   39    33    55    56   0.00000  1.0 1.0
   39    43    49    50   0.30150 -1.0 2.0
   39    43    49    54   0.05850 -1.0 2.0
   39    43    49    54   0.17250  1.0 3.0
   39    43    51    66  -0.32850  1.0 1.0
   39    43    51    66  -0.35800 -1.0 2.0
   39    43    51    66   0.33950  1.0 3.0
   40    39    43    44   0.15000  1.0 3.0
   40    39    43    49  -0.11250  1.0 3.0
   40    39    43    51   0.23400  1.0 3.0
   40    39    45    46   0.19450  1.0 3.0
   43    39    45    46  -0.11600  1.0 1.0
   43    39    45    46  -0.09450 -1.0 2.0
   43    39    45    46   0.21250  1.0 3.0
   43    49    54    57   2.26350  1.0 1.0
   43    49    54    57   0.76750 -1.0 2.0
   43    49    54    57   0.22500  1.0 3.0
   43    49   -54    66   2.26350  1.0 1.0
   43    49   -54    66   0.76750 -1.0 2.0
   43    49   -54    66   0.22500  1.0 3.0
   44    43    49    50   0.00000  1.0 1.0
   44    43    49    54   0.00000  1.0 1.0
   44    43    51    66   0.08050  1.0 3.0
   49    43   -51    66  -0.25600  1.0 1.0
   49    43   -51    66  -0.40050 -1.0 2.0
   49    43   -51    66   0.34700  1.0 3.0
   49    54    57    58   3.62500 -1.0 2.0
   49    54    57    59   3.62500 -1.0 2.0
   49    54    66    62   3.62500 -1.0 2.0
   49    54   -66    51   3.62500 -1.0 2.0
   50    49    54    57   1.05000 -1.0 2.0
   50    49    54    66   1.05000 -1.0 2.0
   54    57    59    60   3.62500 -1.0 2.0
   54    57    59    61   3.62500 -1.0 2.0
   54    66   -51    43   1.63200 -1.0 2.0
   57    54    66    62   3.62500 -1.0 2.0
   57    54    66    51   3.62500 -1.0 2.0
   57    59   -61    62   3.62500 -1.0 2.0
   57    59    61    64   3.62500 -1.0 2.0
   58    57    59    60   3.62500 -1.0 2.0
   58    57    59    61   3.62500 -1.0 2.0
   59    61    62    63   3.62500 -1.0 2.0
   59    61    62    66   3.62500 -1.0 2.0
   59    61    64    65   0.84100 -1.0 2.0
   60    59    61    62   3.62500 -1.0 2.0
   60    59    61    64   3.62500 -1.0 2.0
   61    62   -66    54   3.62500 -1.0 2.0
   61    62    66    51   3.62500 -1.0 2.0
   62    61    64    65   0.84100 -1.0 2.0
   62    66    51    43   1.63200 -1.0 2.0
   63    62    66    54   3.62500 -1.0 2.0
   63    62    66    51   3.62500 -1.0 2.0
   66    54    57    58   3.62500 -1.0 2.0
   66    54   -57    59   3.62500 -1.0 2.0
   51    43    49    50   0.30150 -1.0 2.0
   51    43   -49    54   0.65300  1.0 1.0
   51    43   -49    54  -0.03850 -1.0 2.0
   51    43   -49    54   0.33900  1.0 3.0
   64    61    62    63   3.62500 -1.0 2.0
   64    61    62    66   3.62500 -1.0 2.0
   45    39    43    44   0.23400  1.0 3.0
   45    39    43    49  -0.09450  1.0 1.0
   45    39    43    49  -1.12950 -1.0 2.0
   45    39    43    49   0.54000  1.0 3.0
   45    39    43    51   3.69350  1.0 1.0
   45    39    43    51  -1.82950 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    41   1.10000 -1.0 2.0
   47    42    41    37   1.10000 -1.0 2.0
   41    52    47    48  10.50000 -1.0 2.0
   47    53    52    55   1.10000 -1.0 2.0
   33    56    55    52   1.10000 -1.0 2.0
   43    54    49    50  10.50000 -1.0 2.0
   57    66    54    49   4.00000 -1.0 2.0
   59    58    57    54   1.10000 -1.0 2.0
   61    60    59    57   1.10000 -1.0 2.0
   62    64    61    59   4.00000 -1.0 2.0
   66    63    62    61   1.10000 -1.0 2.0
   62    51    66    54   4.00000 -1.0 2.0
END
