* LIGAND DATABASE FILE (OPLS2005)
*
001      66    66    118    167     335
    1     0 S   NP   _N1_     1    28.81054    96.36991   -23.63155
    2     1 S   H    _HN1     2     1.02950    70.91033    12.75871
    3     1 S   H    _H1_     3     1.02828    38.64812   171.24857
    4     1 S   H    _H2_     4     1.02788   107.09060   -91.27380
    5     1 S   CT   _CA1     5     1.50113   137.28459   112.49341
    6     5 S   HC   _HA1     6     1.09573   105.19410    94.05710
    7     5 S   CO3  _C1_     7     1.53794   112.47451   -26.18469
    8     7 S   O2Z  _O11     8     1.26373   115.00952   -42.32220
    9     7 S   O2Z  _O12     9     1.26241   114.95125   136.82015
   10     5 S   CT   _CB1    10     1.53081   107.41841  -147.94876
   11    10 S   HC   HB11    11     1.09833   109.38597   -49.57331
   12    10 S   HC   HB12    12     1.09813   110.44307    67.04244
   13    10 S   CT   _CG1    13     1.52986   112.59814  -170.54246
   14    13 S   HC   HG11    14     1.09582   110.63569   -65.56993
   15    13 S   HC   HG12    15     1.09670   109.78091    53.65802
   16    13 S   C    _CD1    16     1.51799   112.22965   174.12717
   17    16 S   O    _OE1    17     1.22730   123.29184     7.05719
   18    16 S   N    _N2_    18     1.38643   111.65553  -172.99252
   19    18 S   H    _HN2    19     1.01580   118.94875     1.84047
   20    18 S   CT1  _CA2    20     1.46217   123.45533   177.90351
   21    20 S   HC   _HA2    21     1.09735   109.33739     4.81027
   22    20 S   C    _C2_    22     1.53585   108.86997  -110.76726
   23    22 S   O    _O2_    23     1.23073   122.22728  -149.17050
   24    20 S   CT   _CB2    32     1.53310   111.40485   126.78717
   25    24 S   HC   HB21    33     1.09484   109.85771    56.15512
   26    24 S   HC   HB22    34     1.09523   110.30374   175.20086
   27    22 S   N    _N3_    24     1.38310   113.81470    38.33937
   28    27 S   H    _HN3    25     1.01569   119.60287    -3.30902
   29    24 S   S    _SG2    35     1.82673   111.44545   -65.12747
   30    27 S   CT   _CA3    26     1.45288   123.23486   177.14748
   31    30 S   HC   HA31    27     1.09548   107.51556   -64.65381
   32    30 S   HC   HA32    28     1.09556   107.98551    51.79214
   33    29 S   CT   _C11    36     1.82730    99.43134   178.58986
   34    33 S   HC   _H3_    37     1.09548   110.14018    35.31719
   35    30 S   CO3  _C3_    29     1.52964   114.06664   173.79761
   36    35 S   O2Z  _O31    30     1.26377   116.07008    -0.22381
   37    35 S   O2Z  _O32    31     1.26425   114.41694   179.82983
   38    33 S   CM   _C7_    38     1.50675   110.27213   155.92934
   39    38 S   CMA  _C6_    39     1.35840   122.76291    98.95768
   40    39 S   OM   _O14    40     1.26309   129.25716   176.27795
   41    38 S   CT   _C16    53     1.52529   114.96080   -82.80516
   42    41 S   HC   _H31    54     1.09386   109.54147    48.63790
   43    41 S   HC   _H32    55     1.09728   111.14834   163.02041
   44    39 S   CM   _C4_    41     1.49425   118.64301    -2.39457
   45    41 S   CM   _C9_    56     1.50550   112.07246   -76.82954
   46    45 S   HC   _H17    57     1.09007   113.83762   -69.87515
   47    44 S   CM   _C5_    42     1.35355   121.65219    18.64972
   48    44 S   CT   _C12    49     1.52360   118.24594  -160.81178
   49    48 S   HC   _H19    50     1.09538   110.76839   -77.66333
   50    48 S   HC   _H20    51     1.09362   112.96866   161.12234
   51    48 S   HC   _H21    52     1.09666   111.12549    43.71895
   52    45 S   CM   _C10    58     1.34708   128.10777   111.02374
   53    33 S   CO4  _C8_    43     1.51450   108.80876   -81.59649
   54    53 S   O    _O15    44     1.23206   120.97885    86.95145
   55    47 S   CT   _C13    45     1.50268   126.71908   173.19317
   56    55 S   HC   _H22    46     1.09459   110.14517   103.39444
   57    55 S   HC   _H23    47     1.09293   113.10810   -18.30351
   58    55 S   HC   _H24    48     1.09549   110.97121  -136.68927
   59    52 S   CT   _C14    59     1.50574   120.36596   179.02161
   60    59 S   HC   _H25    60     1.09497   110.26034   119.46747
   61    59 S   HC   _H26    61     1.09511   112.43317    -0.64437
   62    59 S   HC   _H27    62     1.09497   110.21779  -120.72116
   63    52 S   CT   _C15    63     1.50278   125.32085    -1.56160
   64    63 S   HC   _H28    64     1.09492   110.06885   116.96344
   65    63 S   HC   _H29    65     1.09538   110.00316  -123.76502
   66    63 S   HC   _H30    66     1.09167   113.69937    -3.92061
  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   8   5   4   3
  13   6   2   1   1  13  13   4   9   4   3  11  10   3  10   5
   2   1   1   8   5   1   3   2   1   1   7   3   2   1   3   2
   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    53    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    47    53    54    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    44    47    53    54    55    41    42    43    45  
   38    39    47    53    54    41  
   36    37  
   37  
    0  
   39    40    44    47    53    54    48    41    42    43    45    46    52  
   40    44    47    53    55    48    49    50    51    41    42    43    45  
   44    47    48    41  
   42    43    45    46    52    59    63    44    53  
   43    45    46    52  
   45    46    52  
   47    53    54    55    56    57    58    48    49    50    51  
   46    52    59    60    61    62    63    64    65    66  
   52    59    63  
   53    54    55    56    57    58    48    49    50    51  
   49    50    51    53    55  
   50    51  
   51  
    0  
   59    60    61    62    63    64    65    66  
   54    55    56    57    58  
   55  
   56    57    58  
   57    58  
   58  
    0  
   60    61    62    63    64    65    66  
   61    62    63  
   62    63  
   63  
   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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   40   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   41   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   45   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   48   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   53   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    53   317.000  1.522
   38    39   465.000  1.376
   38    41   317.000  1.510
   39    40   745.000  1.250
   39    44   465.000  1.376
   44    47   549.000  1.340
   44    48   317.000  1.510
   47    53   320.000  1.462
   47    55   317.000  1.510
   53    54   570.000  1.229
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   340.000  1.090
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    45   317.000  1.510
   45    46   340.000  1.080
   45    52   549.000  1.340
   52    59   317.000  1.510
   52    63   317.000  1.510
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    53    75.00000  110.18000
   33    38    39    70.00000  124.00000
   33    38    41    65.00000  117.92700
   33    53    47    65.00000  118.62400
   33    53    54    80.00000  120.40000
   38    33    34    35.00000  109.50000
   38    39    40    65.00000  137.10300
   38    39    44    70.00000  123.01800
   38    41    42    35.00000  109.50000
   38    41    43    35.00000  109.50000
   38    41    45    70.00000  110.12100
   39    44    47    70.00000  117.34000
   39    44    48    70.00000  124.00000
   44    39    40    65.00000  137.10300
   44    47    53    65.00000  118.96000
   44    47    55    70.00000  124.00000
   44    48    49    35.00000  109.50000
   44    48    50    35.00000  109.50000
   44    48    51    35.00000  109.50000
   47    53    54    80.00000  123.72100
   47    55    56    35.00000  109.50000
   47    55    57    35.00000  109.50000
   47    55    58    35.00000  109.50000
   53    33    34    35.00000  109.50000
   53    33    38    70.00000  109.06800
   55    47    53    65.00000  116.34900
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   48    44    47    70.00000  124.00000
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    33.00000  107.80000
   41    38    39    70.00000  124.00000
   41    45    46    35.00000  117.00000
   41    45    52    70.00000  124.00000
   43    41    42    33.00000  107.80000
   45    41    42    35.00000  109.50000
   45    41    43    35.00000  109.50000
   45    52    59    70.00000  124.00000
   45    52    63    70.00000  124.00000
   52    45    46    35.00000  120.00000
   52    59    60    35.00000  109.50000
   52    59    61    35.00000  109.50000
   52    59    62    35.00000  109.50000
   52    63    64    35.00000  109.50000
   52    63    65    35.00000  109.50000
   52    63    66    35.00000  109.50000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   63    52    59    65.00000  117.92700
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    53   0.01700  1.0 1.0
   24    29    33    53  -0.23550 -1.0 2.0
   24    29    33    53   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    41   0.30250  1.0 1.0
   29    33    38    41  -0.14950 -1.0 2.0
   29    33    38    41   0.36900  1.0 3.0
   29    33    53    47   0.65300  1.0 1.0
   29    33    53    47  -0.03850 -1.0 2.0
   29    33    53    47   0.33900  1.0 3.0
   29    33    53    54   0.30150 -1.0 2.0
   33    38    39    40   7.00000 -1.0 2.0
   33    38    39    44   7.00000 -1.0 2.0
   33    38    41    42   0.34800  1.0 3.0
   33    38    41    43   0.34800  1.0 3.0
   33    38    41    45   0.09700  1.0 1.0
   33    38    41    45   0.15600 -1.0 2.0
   33    38    41    45  -0.50800  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    41   0.34800  1.0 3.0
   34    33    53    47   0.00000  1.0 1.0
   34    33    53    54   0.00000  1.0 1.0
   38    33    53    47   0.65300  1.0 1.0
   38    33    53    47  -0.03850 -1.0 2.0
   38    33    53    47   0.33900  1.0 3.0
   38    33    53    54   0.30150 -1.0 2.0
   38    39   -44    47   7.00000 -1.0 2.0
   38    39    44    48   7.00000 -1.0 2.0
   38    41    45    46   0.00000  1.0 1.0
   38    41    45    52  -0.28300  1.0 1.0
   38    41    45    52   0.26700 -1.0 2.0
   38    41    45    52  -0.63300  1.0 3.0
   39    38    41    42   0.00000  1.0 1.0
   39    38    41    43   0.00000  1.0 1.0
   39    38    41    45  -0.28300  1.0 1.0
   39    38    41    45   0.26700 -1.0 2.0
   39    38    41    45  -0.63300  1.0 3.0
   39    44    47    53   7.00000 -1.0 2.0
   39    44    47    55   7.00000 -1.0 2.0
   39    44    48    49   0.00000  1.0 1.0
   39    44    48    50   0.00000  1.0 1.0
   39    44    48    51   0.00000  1.0 1.0
   40    39    44    47   7.00000 -1.0 2.0
   40    39    44    48   7.00000 -1.0 2.0
   44    47   -53    33  -0.33500  1.0 1.0
   44    47   -53    33   1.06600 -1.0 2.0
   44    47   -53    33  -0.14000  1.0 3.0
   44    47    53    54   1.00000 -1.0 2.0
   44    47    55    56   0.00000  1.0 1.0
   44    47    55    57   0.00000  1.0 1.0
   44    47    55    58   0.00000  1.0 1.0
   47    44    48    49   0.00000  1.0 1.0
   47    44    48    50   0.00000  1.0 1.0
   47    44    48    51   0.00000  1.0 1.0
   53    33   -38    39  -0.51250  1.0 1.0
   53    33   -38    39  -0.88800 -1.0 2.0
   53    33   -38    39   0.08850  1.0 3.0
   53    33    38    41   0.17250  1.0 1.0
   53    33    38    41  -0.04100 -1.0 2.0
   53    33    38    41  -0.33850  1.0 3.0
   53    47    55    56   0.15000  1.0 3.0
   53    47    55    57   0.15000  1.0 3.0
   53    47    55    58   0.15000  1.0 3.0
   55    47    53    33   0.25700  1.0 1.0
   55    47    53    33   0.66200 -1.0 2.0
   55    47    53    33   0.04450  1.0 3.0
   55    47    53    54  -0.64400  1.0 1.0
   55    47    53    54   0.26850 -1.0 2.0
   48    44    47    53   7.00000 -1.0 2.0
   48    44    47    55   7.00000 -1.0 2.0
   41    38    39    40   7.00000 -1.0 2.0
   41    38    39    44   7.00000 -1.0 2.0
   41    45    52    59   7.00000 -1.0 2.0
   41    45    52    63   7.00000 -1.0 2.0
   42    41    45    46   0.33100  1.0 3.0
   42    41    45    52   0.00000  1.0 1.0
   43    41    45    46   0.33100  1.0 3.0
   43    41    45    52   0.00000  1.0 1.0
   45    52    59    60   0.00000  1.0 1.0
   45    52    59    61   0.00000  1.0 1.0
   45    52    59    62   0.00000  1.0 1.0
   45    52    63    64   0.00000  1.0 1.0
   45    52    63    65   0.00000  1.0 1.0
   45    52    63    66   0.00000  1.0 1.0
   46    45    52    59   7.00000 -1.0 2.0
   46    45    52    63   7.00000 -1.0 2.0
   59    52    63    64   0.34800  1.0 3.0
   59    52    63    65   0.34800  1.0 3.0
   59    52    63    66   0.34800  1.0 3.0
   63    52    59    60   0.34800  1.0 3.0
   63    52    59    61   0.34800  1.0 3.0
   63    52    59    62   0.34800  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    35    36  10.50000 -1.0 2.0
   33    41    38    39   1.10000 -1.0 2.0
   44    40    39    38   1.10000 -1.0 2.0
   39    48    44    47   1.10000 -1.0 2.0
   53    55    47    44   1.10000 -1.0 2.0
   33    47    53    54  10.50000 -1.0 2.0
   41    46    45    52  15.00000 -1.0 2.0
   59    63    52    45  15.00000 -1.0 2.0
END
