* LIGAND DATABASE FILE (OPLS2005)
*
001      65    65    112    163     323
    1     0 S   NP   _N1_     1    28.87563    94.15669   -22.36153
    2     1 S   H    _HN1     2     1.02960    86.91104    27.94618
    3     1 S   H    _H1_     3     1.02835    26.35405   168.30391
    4     1 S   H    _H2_     4     1.02780    99.39455   -80.12505
    5     1 S   CT   _CA1     5     1.50118   135.45015   144.21988
    6     5 S   HC   _HA1     6     1.09575   105.22915    70.31619
    7     5 S   CO3  _C1_     7     1.53776   112.40668   -49.89270
    8     7 S   O2Z  _O11     8     1.26358   115.00294   -43.69799
    9     7 S   O2Z  _O12     9     1.26239   114.91774   135.49132
   10     5 S   CT   _CB1    10     1.53090   107.42693  -171.78169
   11    10 S   HC   HB11    11     1.09826   109.30045   -50.91009
   12    10 S   HC   HB12    12     1.09820   110.42603    65.62260
   13    10 S   CT   _CG1    13     1.53021   112.70054  -172.02007
   14    13 S   HC   HG11    14     1.09593   110.45894   -64.32287
   15    13 S   HC   HG12    15     1.09653   109.97873    54.92222
   16    13 S   C    _CD1    16     1.51805   112.28436   175.24832
   17    16 S   O    _OE1    17     1.22728   123.24290    -1.24238
   18    16 S   N    _N2_    18     1.38649   111.68662   178.92008
   19    18 S   H    _HN2    19     1.01590   119.07043     0.68927
   20    18 S   CT1  _CA2    20     1.46097   123.28510   179.52317
   21    20 S   HC   _HA2    21     1.09589   109.25198    -9.01210
   22    20 S   C    _C2_    22     1.53484   108.69837  -124.15507
   23    22 S   O    _O2_    23     1.23030   122.10509  -147.87879
   24    20 S   CT   _CB2    32     1.53375   111.73866   113.40213
   25    24 S   HC   HB21    33     1.09654   109.63233    60.49666
   26    24 S   HC   HB22    34     1.09569   110.96413   177.89392
   27    22 S   N    _N3_    24     1.38470   113.49130    39.67109
   28    27 S   H    _HN3    25     1.01514   118.92348    -0.91877
   29    24 S   S    _SG2    35     1.82848   114.58474   -59.40404
   30    27 S   CT   _CA3    26     1.45457   123.56093   174.76206
   31    30 S   HC   HA31    27     1.09514   109.36611    21.91824
   32    30 S   HC   HA32    28     1.09497   107.09658   138.97661
   33    29 S   CT   _C12    36     1.82071    99.74689   -68.05495
   34    33 S   HC   _H14    37     1.09333   109.46530    64.94479
   35    33 S   HC   _H15    38     1.09510   109.22267   -53.29466
   36    30 S   CO3  _C3_    29     1.52928   113.00733  -101.62292
   37    36 S   O2Z  _O31    30     1.26410   115.38211   -44.27427
   38    36 S   O2Z  _O32    31     1.26348   114.99229   136.60896
   39    33 S   CT   _C11    39     1.52843   109.83509  -174.15990
   40    39 S   HC   _H12    40     1.09733   109.60486    60.42289
   41    39 S   HC   _H13    41     1.09701   111.86201   -57.41832
   42    39 S   N    _N8_    42     1.46914   111.35648   179.92087
   43    42 S   C    _C10    43     1.40608   120.00849   -91.04946
   44    43 S   O    _O33    44     1.23493   122.43915     0.60716
   45    42 S   NO   _N9_    64     1.41520   120.05138    85.78402
   46    45 S   ON   _O34    65     1.23536   114.45163     0.51889
   47    43 S   N    _N7_    45     1.39122   115.65814  -179.50347
   48    47 S   H    _H11    46     1.01302   120.32806     3.96363
   49    47 S   CT   _C9_    47     1.45220   122.78502   179.78694
   50    49 S   HC   _H9_    48     1.09515   107.86234   146.19578
   51    49 S   HC   _H10    49     1.09634   109.24181    30.85141
   52    49 S   CA   _C7_    50     1.50037   111.66568   -91.92596
   53    52 S   CA   _C6_    51     1.38753   120.28920   102.59856
   54    53 S   HA   _H6_    52     1.08641   121.16482     1.21128
   55    53 S   NB   _N4_    53     1.34645   124.40754  -178.42729
   56    55 S   CQ   _C5_    54     1.34465   115.46455     1.02641
   57    56 S   NB   _N5_    55     1.34977   125.25139    -0.98675
   58    56 S   CT   _C4_    60     1.49530   117.42223  -179.02201
   59    58 S   HC   _H3_    61     1.09382   109.68514    89.46105
   60    58 S   HC   _H4_    62     1.09431   110.63508  -150.49685
   61    58 S   HC   _H5_    63     1.09432   110.66466   -30.59719
   62    52 S   CA   _C8_    56     1.39341   124.02954   -75.49954
   63    62 S   NE   _N6_    57     1.39136   121.08260     0.85547
   64    63 S   H    _H7_    58     1.01094   119.32276   -33.71228
   65    63 S   H    _H8_    59     1.01293   115.99542   177.95914
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   7   5   4   3
   8   5   4   2   1   1   8   4   3   7   9   4   2   1   7   4
   9   4   3   9   7   3   7   7   8   4   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    42  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    45  
   35    39    40    41    42  
   39    40    41    42  
   37    38  
   38  
    0  
   40    41    42    43    44    47    45    46  
   41    42    43    45  
   42    43    45  
   43    44    47    48    49    45    46  
   44    47    48    49    50    51    52    45    46  
   47    48    49    45  
   46    47  
    0  
   48    49    50    51    52    53    62  
   49    50    51    52  
   50    51    52    53    54    55    57    62    63  
   51    52    53    62  
   52    53    62  
   53    54    55    56    57    62    63    64    65  
   54    55    56    57    62    63    58  
   55    56    62  
   56    57    62    58    59    60    61  
   57    62    63    58    59    60    61  
   62    63    64    65    58    59    60    61  
   59    60    61    62  
   60    61  
   61  
    0  
   63    64    65  
   64    65  
   65  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660   0.002500   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.2500   0.1700  -0.245000   1.8100   1.6000   0.054801302  -1.445846770
   43   3.7500   0.1050   0.813700   1.9250   1.7000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.616300   1.5250   1.4250   0.001000000  -1.480495490
   45   3.2500   0.1200   0.161700   1.8375   1.6250   0.005000000   0.000000000
   46   2.9600   0.1700  -0.161700   1.6780   1.4800   0.001000000  -0.126889456
   47   3.2500   0.1700  -0.518100   1.8100   1.6000   0.054801302  -1.445846770
   48   0.5000   0.0300   0.291200   1.5900   1.4000   0.030040813  -0.651083722
   49   3.5000   0.0660   0.147000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   52   3.5500   0.0700  -0.607000   2.0020   1.7750   0.001000000  -0.843144165
   53   3.5500   0.0700   0.653000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.011000   1.3810   1.2100   0.030040813   0.268726247
   55   3.2500   0.1700  -0.839000   1.8000   1.6000   0.001000000  -0.511443539
   56   3.5500   0.0700   0.727000   2.0020   1.7750   0.001000000  -0.843144165
   57   3.2500   0.1700  -0.839000   1.8000   1.6000   0.001000000  -0.511443539
   58   3.5000   0.0660  -0.065000   2.4950   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   3.5500   0.0700   0.864000   2.0020   1.7750   0.001000000  -0.843144165
   63   3.3000   0.1700  -0.920000   1.8650   1.6500   0.051222218  -2.220205820
   64   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   65   0.5000   0.0300   0.360000   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   337.000  1.449
   42    43   490.000  1.335
   42    45   305.000  1.341
   43    44   570.000  1.229
   43    47   490.000  1.335
   47    48   434.000  1.010
   47    49   337.000  1.449
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   317.000  1.510
   52    53   469.000  1.400
   52    62   469.000  1.400
   53    54   367.000  1.080
   53    55   483.000  1.339
   55    56   502.000  1.324
   56    57   502.000  1.324
   56    58   317.000  1.510
   57    62   483.000  1.339
   62    63   481.000  1.340
   63    64   434.000  1.010
   63    65   434.000  1.010
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   45    46   775.000  1.212
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    70.00000  110.72300
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    42    43    50.00000  121.90000
   39    42    45    85.00000  117.02000
   41    39    40    33.00000  107.80000
   42    39    40    35.00000  109.50000
   42    39    41    35.00000  109.50000
   42    43    44    80.00000  122.90000
   42    43    47    90.00000  111.91700
   42    45    46   110.00000  112.00000
   43    47    48    35.00000  119.80000
   43    47    49    50.00000  121.90000
   47    43    44    80.00000  122.90000
   47    49    50    35.00000  109.50000
   47    49    51    35.00000  109.50000
   47    49    52    75.00000  111.96400
   49    47    48    38.00000  118.40000
   49    52    53    70.00000  120.00000
   49    52    62    70.00000  120.00000
   51    49    50    33.00000  107.80000
   52    49    50    35.00000  109.50000
   52    49    51    35.00000  109.50000
   52    53    54    35.00000  120.00000
   52    53    55    70.00000  124.00000
   52    62    57    70.00000  124.00000
   52    62    63    70.00000  120.10000
   53    55    56    70.00000  118.60000
   55    53    54    35.00000  116.00000
   55    56    57    70.00000  129.10000
   55    56    58    75.00000  115.74700
   56    57    62    70.00000  118.60000
   56    58    59    35.00000  109.50000
   56    58    60    35.00000  109.50000
   56    58    61    35.00000  109.50000
   57    62    63    80.00000  117.25000
   62    52    53    63.00000  120.00000
   62    63    64    35.00000  113.50000
   62    63    65    35.00000  113.50000
   65    63    64    35.00000  109.00000
   58    56    57    75.00000  115.74700
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   45    42    43    75.00000  121.16600
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    35   0.32350  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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    42   0.56750  1.0 1.0
   29    33    39    42  -0.07550 -1.0 2.0
   29    33    39    42   0.20000  1.0 3.0
   33    39    42    43  -0.43950  1.0 1.0
   33    39    42    43  -0.08100 -1.0 2.0
   33    39    42    43   0.03350  1.0 3.0
   33    39    42    45   0.17850 -1.0 2.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    42   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    42   0.15000  1.0 3.0
   39    42    43    44   3.04450 -1.0 2.0
   39    42    43    47   4.56800  1.0 1.0
   39    42    43    47   0.31650 -1.0 2.0
   39    42    45    46   2.00000 -1.0 2.0
   40    39    42    43   0.00000  1.0 1.0
   40    39    42    45   0.00000  1.0 1.0
   41    39    42    43   0.00000  1.0 1.0
   41    39    42    45   0.00000  1.0 1.0
   42    43    47    48   2.56700 -1.0 2.0
   42    43    47    49   4.56800  1.0 1.0
   42    43    47    49   0.31650 -1.0 2.0
   43    42    45    46   2.00000 -1.0 2.0
   43    47    49    50   0.00000  1.0 1.0
   43    47    49    51   0.00000  1.0 1.0
   43    47    49    52  -0.69800  1.0 1.0
   43    47    49    52  -0.21350 -1.0 2.0
   44    43    47    48   2.45000 -1.0 2.0
   44    43    47    49   3.04450 -1.0 2.0
   47    49    52    53  -0.24500  1.0 1.0
   47    49    52    53   0.48300 -1.0 2.0
   47    49    52    53   0.08900  1.0 3.0
   47    49    52    62  -0.24500  1.0 1.0
   47    49    52    62   0.48300 -1.0 2.0
   47    49    52    62   0.08900  1.0 3.0
   48    47    49    50   0.00000  1.0 1.0
   48    47    49    51   0.00000  1.0 1.0
   48    47    49    52   0.00000  1.0 1.0
   49    52    53    54   3.62500 -1.0 2.0
   49    52    53    55   3.62500 -1.0 2.0
   49    52    62    57   3.62500 -1.0 2.0
   49    52    62    63   3.62500 -1.0 2.0
   50    49    52    53   0.00000  1.0 1.0
   50    49    52    62   0.00000  1.0 1.0
   51    49    52    53   0.00000  1.0 1.0
   51    49    52    62   0.00000  1.0 1.0
   52    53    55    56   3.62500 -1.0 2.0
   52    62    63    64   1.00000 -1.0 2.0
   52    62    63    65   1.00000 -1.0 2.0
   53    52    62    57   3.62500 -1.0 2.0
   53    52    62    63   3.62500 -1.0 2.0
   53    55   -56    57   3.62500 -1.0 2.0
   53    55    56    58   3.62500 -1.0 2.0
   54    53    55    56   3.62500 -1.0 2.0
   55    56    57    62   3.62500 -1.0 2.0
   55    56    58    59   0.00000  1.0 1.0
   55    56    58    60   0.00000  1.0 1.0
   55    56    58    61   0.00000  1.0 1.0
   56    57   -62    52   3.62500 -1.0 2.0
   56    57    62    63   3.62500 -1.0 2.0
   57    56    58    59   0.00000  1.0 1.0
   57    56    58    60   0.00000  1.0 1.0
   57    56    58    61   0.00000  1.0 1.0
   57    62    63    64   1.75000 -1.0 2.0
   57    62    63    65   1.75000 -1.0 2.0
   62    52    53    54   3.62500 -1.0 2.0
   62    52   -53    55   3.62500 -1.0 2.0
   58    56    57    62   3.62500 -1.0 2.0
   45    42    43    44  -0.75150  1.0 1.0
   45    42    43    44   0.83450 -1.0 2.0
   45    42    43    47   0.63000  1.0 1.0
   45    42    43    47   1.73150 -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
   37    30    36    38  10.50000 -1.0 2.0
   45    43    42    39   1.00000 -1.0 2.0
   42    47    43    44  10.50000 -1.0 2.0
   48    43    47    49   1.00000 -1.0 2.0
   53    62    52    49   4.00000 -1.0 2.0
   55    54    53    52   1.10000 -1.0 2.0
   58    57    56    55   4.00000 -1.0 2.0
   57    63    62    52   4.00000 -1.0 2.0
   65    62    63    64   1.00000 -1.0 2.0
END
