* LIGAND DATABASE FILE (OPLS2005)
*
001      66    68    123    198     364
    1     0 S   NP   _N1_     1    29.08088    95.12650   -19.29731
    2     1 S   H    _HN1     2     1.02958    97.76664    41.59790
    3     1 S   H    _H1_     3     1.02834    35.87113   150.03324
    4     1 S   H    _H2_     4     1.02776    78.66659   -65.65039
    5     1 S   CT   _CA1     5     1.50141   143.35874  -177.82939
    6     5 S   HC   _HA1     6     1.09575   105.21269    39.69547
    7     5 S   CO3  _C1_     7     1.53848   112.29975   -80.42457
    8     7 S   O2Z  _O11     8     1.26374   114.98832   -43.87924
    9     7 S   O2Z  _O12     9     1.26241   114.92329   135.11833
   10     5 S   CT   _CB1    10     1.53108   107.39298   157.55171
   11    10 S   HC   HB11    11     1.09810   109.37904   -50.12654
   12    10 S   HC   HB12    12     1.09822   110.42278    66.47349
   13    10 S   CT   _CG1    13     1.52958   112.60722  -171.29694
   14    13 S   HC   HG11    14     1.09444   110.17778   -60.89101
   15    13 S   HC   HG12    15     1.09631   110.18914    57.97299
   16    13 S   C    _CD1    16     1.51861   112.20704   177.89216
   17    16 S   O    _OE1    17     1.22743   123.07997   -17.60324
   18    16 S   N    _N2_    18     1.38538   111.80935   163.87338
   19    18 S   H    _HN2    19     1.01579   118.82685    -0.74336
   20    18 S   CT1  _CA2    20     1.46235   123.66843  -179.83807
   21    20 S   HC   _HA2    21     1.09728   109.35244   -18.27593
   22    20 S   C    _C2_    22     1.53442   107.84591  -133.87811
   23    22 S   O    _O2_    23     1.23000   122.35870  -144.58156
   24    20 S   CT   _CB2    32     1.53534   111.45421   104.24452
   25    24 S   HC   HB21    33     1.09447   109.39764    52.93203
   26    24 S   HC   HB22    34     1.09513   110.49491   171.01078
   27    22 S   N    _N3_    24     1.38541   113.27386    42.65278
   28    27 S   H    _HN3    25     1.01538   118.91519    -0.41117
   29    24 S   S    _SG2    35     1.83212   111.71673   -70.52590
   30    27 S   CT   _CA3    26     1.45442   123.39474   175.26017
   31    30 S   HC   HA31    27     1.09528   109.16171    25.71024
   32    30 S   HC   HA32    28     1.09494   107.13579   142.69917
   33    29 S   CT   _C11    36     1.83473   102.29792   142.38211
   34    30 S   CO3  _C3_    29     1.52928   113.18008   -97.71873
   35    34 S   O2Z  _O31    30     1.26397   115.43609   -43.79075
   36    34 S   O2Z  _O32    31     1.26359   114.95879   137.15383
   37    33 S   CD   _C10    37     1.50075   112.18722   -56.43862
   38    33 S   CT   _C12    52     1.54544   109.16569  -174.84706
   39    38 S   HC   _H8_    53     1.09995   109.77612   156.76581
   40    38 S   HC   _H9_    54     1.09825   111.17312    41.40450
   41    37 S   OS   _O34    38     1.36417   109.50542   144.26770
   42    37 S   NI   _N4_    55     1.29376   125.32273   -39.40401
   43    41 S   CO4  _C17    39     1.36574   110.40244    -8.40270
   44    43 S   O    _O33    40     1.22012   124.57202   172.71700
   45    42 S   CA   _C9_    56     1.40292   118.11223  -178.70020
   46    33 S   CT   _C16    41     1.52877   113.04905    57.39936
   47    46 S   HC   _H3_    42     1.09736   112.33644   -37.07512
   48    45 S   CA   _C4_    57     1.39881   119.75810   105.23504
   49    48 S   HA   _H4_    58     1.08719   120.11606    -1.56773
   50    46 S   CT   _C15    43     1.52637   115.92157    87.84044
   51    50 S   HC   _H14    44     1.09772   108.38981   -78.56313
   52    50 S   HC   _H15    45     1.09649   110.42094   165.27316
   53    48 S   CA   _C5_    59     1.39567   120.48158   177.75179
   54    53 S   HA   _H5_    60     1.08653   119.25531  -179.71196
   55    50 S   CT   _C14    46     1.52291   113.97067    42.11183
   56    55 S   HC   _H12    47     1.09594   109.50863  -173.86995
   57    55 S   HC   _H13    48     1.09674   109.82131    69.09756
   58    53 S   CA   _C6_    61     1.39391   119.62551    -0.39860
   59    58 S   Br   Br1_    62     1.89109   119.72401  -179.73830
   60    55 S   CT   _C13    49     1.52119   111.11975   -52.61665
   61    60 S   HC   _H10    50     1.09602   109.49036   179.70859
   62    60 S   HC   _H11    51     1.09614   110.08775   -63.11070
   63    58 S   CA   _C7_    63     1.39410   120.55121    -0.05595
   64    63 S   HA   _H6_    64     1.08650   121.06203  -179.58788
   65    45 S   CA   _C8_    65     1.40096   120.88786   -77.95342
   66    65 S   HA   _H7_    66     1.08692   120.16850     2.03009
  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  12   5   4   3
  18   2   1   1  14  14   6   5   7   9   7   3   9   8   4   8
   4   8   5   4   6   3   5   4   3   5   3   2   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    46    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    43    46    47    50    60    38    39    40    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    43    44    46    47    50    51    52    55    60    61    62    38    39    40    42    45  
   35    36  
   36  
    0  
   41    43    44    46    47    50    60    38    39    40    42    45    48    65  
   39    40    42    41    43    46    47    50    55    56    57    60    61    62  
   40    46    55    60    61    62  
   46    55    60    61    62  
   43    44    46    47    50    42    45  
   45    48    49    53    63    65    66    43    46  
   44    46    47    50    51    52    55  
   46    47    50  
   48    49    53    54    58    63    64    65    66  
   47    50    51    52    55    56    57    60  
   50    51    52    55  
   49    53    54    58    59    63    65    66  
   53    54    58    65  
   51    52    55    56    57    60    61    62  
   52    55    56    57    60  
   55    56    57    60  
   54    58    59    63    64    65  
   58    59    63  
   56    57    60    61    62  
   57    60    61    62  
   60    61    62  
   59    63    64    65    66  
   63    64    65  
   61    62  
   62  
    0  
   64    65    66  
   65    66  
   66  
    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   0.203600   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   0.438600   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.0000   0.1700  -0.165000   1.5900   1.4000   0.020110767  -0.896042159
   42   3.2800   0.1700  -0.468500   1.8540   1.6400   0.005000000   0.000000000
   43   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5500   0.0700   0.078800   2.0020   1.7750   0.001000000  -0.843144165
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5000   0.0660  -0.120000   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   0.200000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.4700   0.4700  -0.200000   2.8000   2.5000   0.001000000  -0.686339560
   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  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
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   270.000  1.508
   33    46   268.000  1.529
   33    38   268.000  1.529
   37    41   445.000  1.361
   37    42   500.000  1.261
   41    43   214.000  1.327
   43    44   570.000  1.229
   43    46   317.000  1.522
   46    47   340.000  1.090
   46    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    55   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    38   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   42    45   400.000  1.385
   45    48   469.000  1.400
   45    65   469.000  1.400
   48    49   367.000  1.080
   48    53   469.000  1.400
   53    54   367.000  1.080
   53    58   469.000  1.400
   58    59   300.000  1.903
   58    63   469.000  1.400
   63    64   367.000  1.080
   63    65   469.000  1.400
   65    66   367.000  1.080
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  114.43000
   29    33    46    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    37    41    85.00000  110.80600
   33    37    42    65.00000  122.10100
   33    46    43    63.00000  111.10000
   33    46    47    37.50000  110.70000
   33    46    50    58.35000  112.70000
   33    38    60    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   37    41    43    90.00000  116.67500
   37    42    45    70.00000  113.96500
   41    43    44    83.00000  123.40000
   41    43    46    81.00000  111.40000
   43    46    47    35.00000  109.50000
   43    46    50    63.00000  111.10000
   46    33    37    70.00000  111.76100
   46    43    44    80.00000  120.40000
   46    50    51    37.50000  110.70000
   46    50    52    37.50000  110.70000
   46    50    55    58.35000  112.70000
   50    46    47    37.50000  110.70000
   50    55    56    37.50000  110.70000
   50    55    57    37.50000  110.70000
   50    55    60    58.35000  112.70000
   52    50    51    33.00000  107.80000
   55    50    51    37.50000  110.70000
   55    50    52    37.50000  110.70000
   55    60    61    37.50000  110.70000
   55    60    62    37.50000  110.70000
   55    60    38    58.35000  112.70000
   57    55    56    33.00000  107.80000
   60    55    56    37.50000  110.70000
   60    55    57    37.50000  110.70000
   60    38    39    37.50000  110.70000
   60    38    40    37.50000  110.70000
   62    60    61    33.00000  107.80000
   38    33    37    70.00000  111.76100
   38    33    46    58.35000  112.70000
   38    60    61    37.50000  110.70000
   38    60    62    37.50000  110.70000
   40    38    39    33.00000  107.80000
   42    37    41    85.00000  121.08200
   42    45    48    70.00000  120.44500
   42    45    65    70.00000  120.44500
   45    48    49    35.00000  120.00000
   45    48    53    63.00000  120.00000
   45    65    63    63.00000  120.00000
   45    65    66    35.00000  120.00000
   48    53    54    35.00000  120.00000
   48    53    58    63.00000  120.00000
   53    48    49    35.00000  120.00000
   53    58    59    75.00000  120.00000
   53    58    63    63.00000  120.00000
   58    53    54    35.00000  120.00000
   58    63    64    35.00000  120.00000
   58    63    65    63.00000  120.00000
   63    58    59    75.00000  120.00000
   63    65    66    35.00000  120.00000
   65    45    48    63.00000  120.00000
   65    63    64    35.00000  120.00000
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    46   0.01700  1.0 1.0
   24    29    33    46  -0.23550 -1.0 2.0
   24    29    33    46   0.21350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    41   0.00000  1.0 1.0
   29    33    37    42   0.00000  1.0 1.0
   29    33    46    43   0.56750  1.0 1.0
   29    33    46    43  -0.07550 -1.0 2.0
   29    33    46    43   0.20000  1.0 3.0
   29    33    46    47   0.15000  1.0 3.0
   29    33    46    50   0.44750  1.0 1.0
   29    33    46    50  -0.17800 -1.0 2.0
   29    33    46    50   0.20200  1.0 3.0
   29    33    38    60   0.44750  1.0 1.0
   29    33    38    60  -0.17800 -1.0 2.0
   29    33    38    60   0.20200  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   33    37   -41    43   1.50000 -1.0 2.0
   33    37    42    45   6.00000 -1.0 2.0
   33    46    50    51   0.15000  1.0 3.0
   33    46    50    52   0.15000  1.0 3.0
   33    46    50    55   0.56750  1.0 1.0
   33    46    50    55  -0.07550 -1.0 2.0
   33    46    50    55   0.20000  1.0 3.0
   37    33   -46    43  -0.98800  1.0 1.0
   37    33   -46    43   0.48800 -1.0 2.0
   37    33   -46    43   0.76800  1.0 3.0
   37    33    46    47   0.15000  1.0 3.0
   37    33    46    50   0.34400  1.0 1.0
   37    33    46    50   0.09450 -1.0 2.0
   37    33    46    50   0.11100  1.0 3.0
   37    33    38    60   0.34400  1.0 1.0
   37    33    38    60   0.09450 -1.0 2.0
   37    33    38    60   0.11100  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  1.0 3.0
   37    41    43    44   3.00000 -1.0 2.0
   37    41   -43    46   0.82650  1.0 1.0
   37    41   -43    46   1.69000 -1.0 2.0
   37    42    45    48   1.25000 -1.0 2.0
   37    42    45    65   1.25000 -1.0 2.0
   41    37    42    45   6.00000 -1.0 2.0
   41    43   -46    33   0.36750  1.0 3.0
   41    43    46    47   0.00000  1.0 1.0
   41    43    46    50   0.36750  1.0 3.0
   43    46    50    51  -0.11250  1.0 3.0
   43    46    50    52  -0.11250  1.0 3.0
   43    46    50    55  -0.95700  1.0 1.0
   43    46    50    55  -0.18200 -1.0 2.0
   43    46    50    55   0.29450  1.0 3.0
   44    43    46    33   0.30150 -1.0 2.0
   44    43    46    47   0.00000  1.0 1.0
   44    43    46    50   0.30150 -1.0 2.0
   46    33   -37    41   0.00000  1.0 1.0
   46    33    37    42   0.00000  1.0 1.0
   46    33    38    60   0.56750  1.0 1.0
   46    33    38    60  -0.07550 -1.0 2.0
   46    33    38    60   0.20000  1.0 3.0
   46    33    38    39   0.15000  1.0 3.0
   46    33    38    40   0.15000  1.0 3.0
   46    50    55    56   0.15000  1.0 3.0
   46    50    55    57   0.15000  1.0 3.0
   46    50   -55    60   0.56750  1.0 1.0
   46    50   -55    60  -0.07550 -1.0 2.0
   46    50   -55    60   0.20000  1.0 3.0
   47    46    50    51   0.15000  1.0 3.0
   47    46    50    52   0.15000  1.0 3.0
   47    46    50    55   0.15000  1.0 3.0
   50    55    60    61   0.15000  1.0 3.0
   50    55    60    62   0.15000  1.0 3.0
   50    55    60    38   0.56750  1.0 1.0
   50    55    60    38  -0.07550 -1.0 2.0
   50    55    60    38   0.20000  1.0 3.0
   51    50    55    56   0.15000  1.0 3.0
   51    50    55    57   0.15000  1.0 3.0
   51    50    55    60   0.15000  1.0 3.0
   52    50    55    56   0.15000  1.0 3.0
   52    50    55    57   0.15000  1.0 3.0
   52    50    55    60   0.15000  1.0 3.0
   55    60   -38    33   0.56750  1.0 1.0
   55    60   -38    33  -0.07550 -1.0 2.0
   55    60   -38    33   0.20000  1.0 3.0
   55    60    38    39   0.15000  1.0 3.0
   55    60    38    40   0.15000  1.0 3.0
   56    55    60    61   0.15000  1.0 3.0
   56    55    60    62   0.15000  1.0 3.0
   56    55    60    38   0.15000  1.0 3.0
   57    55    60    61   0.15000  1.0 3.0
   57    55    60    62   0.15000  1.0 3.0
   57    55    60    38   0.15000  1.0 3.0
   61    60    38    33   0.15000  1.0 3.0
   61    60    38    39   0.15000  1.0 3.0
   61    60    38    40   0.15000  1.0 3.0
   62    60    38    33   0.15000  1.0 3.0
   62    60    38    39   0.15000  1.0 3.0
   62    60    38    40   0.15000  1.0 3.0
   38    33    37    41   0.00000  1.0 1.0
   38    33    37    42   0.00000  1.0 1.0
   38    33    46    43  -0.95700  1.0 1.0
   38    33    46    43  -0.18200 -1.0 2.0
   38    33    46    43   0.29450  1.0 3.0
   38    33    46    47   0.15000  1.0 3.0
   38    33   -46    50   0.56750  1.0 1.0
   38    33   -46    50  -0.07550 -1.0 2.0
   38    33   -46    50   0.20000  1.0 3.0
   42    37    41    43   1.50000 -1.0 2.0
   42    45    48    49   3.62500 -1.0 2.0
   42    45    48    53   3.62500 -1.0 2.0
   42    45    65    63   3.62500 -1.0 2.0
   42    45    65    66   3.62500 -1.0 2.0
   45    48    53    54   3.62500 -1.0 2.0
   45    48    53    58   3.62500 -1.0 2.0
   48    45    65    63   3.62500 -1.0 2.0
   48    45    65    66   3.62500 -1.0 2.0
   48    53    58    59   3.62500 -1.0 2.0
   48    53   -58    63   3.62500 -1.0 2.0
   49    48    53    54   3.62500 -1.0 2.0
   49    48    53    58   3.62500 -1.0 2.0
   53    58    63    64   3.62500 -1.0 2.0
   53    58    63    65   3.62500 -1.0 2.0
   54    53    58    59   3.62500 -1.0 2.0
   54    53    58    63   3.62500 -1.0 2.0
   58    63   -65    45   3.62500 -1.0 2.0
   58    63    65    66   3.62500 -1.0 2.0
   59    58    63    64   3.62500 -1.0 2.0
   59    58    63    65   3.62500 -1.0 2.0
   64    63    65    45   3.62500 -1.0 2.0
   64    63    65    66   3.62500 -1.0 2.0
   65    45    48    49   3.62500 -1.0 2.0
   65    45   -48    53   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    41    37    42  10.50000 -1.0 2.0
   41    46    43    44  10.50000 -1.0 2.0
   48    65    45    42   4.00000 -1.0 2.0
   53    49    48    45   1.10000 -1.0 2.0
   58    54    53    48   1.10000 -1.0 2.0
   63    59    58    53   4.00000 -1.0 2.0
   65    64    63    58   1.10000 -1.0 2.0
   63    66    65    45   1.10000 -1.0 2.0
END
