* LIGAND DATABASE FILE (OPLS2005)
*
001      66    66    118    177     351
    1     0 S   NP   _N1_     1    28.04735    95.76372   -21.49014
    2     1 S   H    _HN1     2     1.02786    95.99218  -127.87953
    3     1 S   H    _H1_     3     1.02948    80.16178   -20.26198
    4     1 S   H    _H2_     4     1.02845    35.17155   119.46978
    5     1 S   CT   _CA1     5     1.50104   143.37319    90.98692
    6     5 S   HC   _HA1     6     1.09560   105.26911    76.39389
    7     5 S   CO3  _C1_     7     1.53828   112.28077   -44.06244
    8     7 S   O2Z  _O11     8     1.26398   115.00777   -45.31420
    9     7 S   O2Z  _O12     9     1.26213   114.95426   133.96778
   10     5 S   CT   _CB1    10     1.53095   107.48653  -165.44554
   11    10 S   HC   HB11    11     1.09831   109.67869   -48.05390
   12    10 S   HC   HB12    12     1.09794   110.28588    68.47783
   13    10 S   CT   _CG1    13     1.53065   112.58436  -168.87429
   14    13 S   HC   HG11    14     1.09522   110.78017   -60.10639
   15    13 S   HC   HG12    15     1.09644   109.76273    59.07410
   16    13 S   C    _CD1    16     1.51783   112.10330   179.85196
   17    16 S   O    _OE1    17     1.22769   123.06740     7.77150
   18    16 S   N    _N2_    18     1.38504   111.90290  -172.93684
   19    18 S   H    _HN2    19     1.01546   119.16263     3.90706
   20    18 S   CT1  _CA2    20     1.45934   122.84288  -179.79537
   21    20 S   HC   _HA2    21     1.09650   108.43430    32.06825
   22    20 S   C    _C2_    22     1.52949   107.24372   -85.05400
   23    22 S   O    _O2_    23     1.22986   123.05147   -26.55662
   24    20 S   CT   _CB2    32     1.53305   112.17783   155.54313
   25    24 S   HC   HB21    33     1.09657   109.80655    57.08508
   26    24 S   HC   HB22    34     1.09557   111.53362   174.92592
   27    22 S   N    _N3_    24     1.38502   112.58897   156.19144
   28    27 S   H    _HN3    25     1.01669   120.37786    -2.36959
   29    24 S   S    _SG2    35     1.82344   112.65464   -61.99322
   30    27 S   CT   _CA3    26     1.45360   122.37656   178.67116
   31    30 S   HC   HA31    27     1.09570   107.86085   -54.62230
   32    30 S   HC   HA32    28     1.09565   107.54241    61.68168
   33    29 S   CT   _C11    36     1.82950    99.77231   -82.41548
   34    33 S   HC   _H11    37     1.09477   108.97581    33.57007
   35    33 S   HC   _H12    38     1.09495   107.06169   -83.90326
   36    30 S   CO3  _C3_    29     1.52863   114.41861  -176.56647
   37    36 S   O2Z  _O31    30     1.26316   116.08964     0.82756
   38    36 S   O2Z  _O32    31     1.26447   114.39641  -179.24101
   39    33 S   CT   _C10    39     1.52995   110.14275   154.77536
   40    39 S   HC   _H8_    40     1.09787   111.25590    39.12664
   41    39 S   CO3  _C12    41     1.54112   108.05701   159.90609
   42    41 S   O2Z  _O36    42     1.26342   116.25810    48.52609
   43    41 S   O2Z  _O35    43     1.26524   114.49419  -131.49956
   44    39 S   OS1  _O34    44     1.43303   108.36600   -83.44684
   45    44 S   CO1  _C9_    45     1.43094   113.73163   156.74967
   46    45 S   HC   _H7_    46     1.09623   108.77493    43.27095
   47    45 S   CT   _C8_    47     1.53561   110.59126   161.49729
   48    47 S   HC   _H6_    48     1.09751   107.94945  -173.51777
   49    47 S   CT   _C7_    49     1.53400   111.98209    67.71045
   50    49 S   HC   _H5_    50     1.09623   109.01400   173.86480
   51    47 S   OH5  _O37    65     1.42411   110.26413   -56.82233
   52    51 S   HO   _H13    66     0.97166   107.82957   172.07051
   53    49 S   CT   _C6_    51     1.53094   109.71713    52.20950
   54    53 S   HC   _H4_    52     1.09498   110.27663  -170.51778
   55    49 S   OH5  _O38    63     1.42488   109.92191   -69.09786
   56    55 S   HO   _H14    64     0.97253   108.51314   177.69735
   57    53 S   CT   _C5_    53     1.53884   111.45768   -49.85155
   58    57 S   HC   _H3_    54     1.09567   109.73802   -66.30960
   59    53 S   OH5  _O39    61     1.42730   109.12325    71.34726
   60    59 S   HO   _H15    62     0.97288   107.39225    70.28536
   61    45 S   OS1  _O33    55     1.43337   112.55026   -76.02590
   62    57 S   CT   _C4_    56     1.52990   111.62485   173.07006
   63    62 S   HC   _H9_    57     1.09377   111.05241    48.61538
   64    62 S   HC   _H10    58     1.09482   111.39357   -73.81599
   65    62 S   OH5  _O40    59     1.42496   109.27418   167.40162
   66    65 S   HO   _H16    60     0.97219   106.91258   179.57113
  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
   9   5   4   2   1   1   9   5   4   2   1   8  13   6  12   7
  13   7   4   1  12   7   3   1   9   6   3   1   4   4   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    44  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44    45  
   35    39    40    41    44  
   39    40    41    44  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    47    61  
   41    42    43    44    45  
   42    43    44    45  
   43    44  
   44  
   45    46    47    48    49    57    61    51  
   46    47    48    49    50    53    57    58    61    62    55    51    52  
   47    48    49    57    61    51  
   48    49    50    53    54    57    61    59    55    56    51    52  
   49    50    53    61    55    51    52  
   50    53    54    57    58    61    62    59    60    55    56    51    52  
   53    54    57    59    55    56    51  
   52    53    55    61  
    0  
   54    57    58    61    62    63    64    65    59    60    55    56  
   57    58    61    62    59    60    55  
   56    57    59  
    0  
   58    61    62    63    64    65    66    59    60  
   61    62    63    64    65    59  
   60    61    62  
    0  
   62    63    64    65  
   63    64    65    66  
   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   0.047500   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   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   44   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   45   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   57   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   59   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   61   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   62   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.418000   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   317.000  1.522
   39    44   335.000  1.422
   41    42   656.000  1.250
   41    43   656.000  1.250
   44    45   370.000  1.399
   45    46   360.000  1.097
   45    47   255.000  1.525
   45    61   370.000  1.399
   47    48   340.000  1.090
   47    49   268.000  1.529
   47    51   355.000  1.421
   49    50   340.000  1.090
   49    53   268.000  1.529
   49    55   355.000  1.421
   53    54   340.000  1.090
   53    57   268.000  1.529
   53    59   355.000  1.421
   57    58   340.000  1.090
   57    61   335.000  1.422
   57    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   355.000  1.421
   65    66   580.000  0.967
   59    60   580.000  0.967
   55    56   580.000  0.967
   51    52   580.000  0.967
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    70.00000  109.69300
   33    39    44    95.00000  107.88500
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    70.00000  117.00000
   39    41    43    70.00000  117.00000
   39    44    45    90.00000  112.10700
   41    39    40    35.00000  109.50000
   43    41    42    80.00000  126.00000
   44    39    40    55.00000  108.98800
   44    39    41    85.00000  109.63000
   44    45    46    60.00000  105.75400
   44    45    47    90.00000  109.70700
   44    45    61   110.00000  113.16000
   45    47    48    45.00000  109.54000
   45    47    49    70.00000  111.10000
   45    47    51    90.00000  109.42000
   45    61    57    90.00000  112.10700
   47    45    46    45.00000  111.65000
   47    49    50    37.50000  110.70000
   47    49    53    58.35000  112.70000
   47    49    55    90.00000  111.45300
   47    51    52    65.00000  108.53500
   49    47    48    37.50000  110.70000
   49    53    54    37.50000  110.70000
   49    53    57    58.35000  112.70000
   49    53    59    90.00000  111.45300
   49    55    56    65.00000  108.53500
   53    49    50    37.50000  110.70000
   53    57    58    37.50000  110.70000
   53    57    61    95.00000  107.88500
   53    57    62    58.35000  112.70000
   53    59    60    65.00000  108.53500
   57    53    54    37.50000  110.70000
   57    62    63    37.50000  110.70000
   57    62    64    37.50000  110.70000
   57    62    65    90.00000  111.45300
   61    45    46    60.00000  105.75400
   61    45    47    90.00000  109.70700
   61    57    58    55.00000  108.98800
   62    57    58    37.50000  110.70000
   62    57    61    95.00000  107.88500
   62    65    66    65.00000  108.53500
   64    62    63    33.00000  107.80000
   65    62    63    60.00000  109.39000
   65    62    64    60.00000  109.39000
   59    53    54    60.00000  109.39000
   59    53    57    90.00000  111.45300
   55    49    50    60.00000  109.39000
   55    49    53    90.00000  111.45300
   51    47    48    60.00000  109.39000
   51    47    49    90.00000  111.45300
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   0.56750  1.0 1.0
   29    33    39    41  -0.07550 -1.0 2.0
   29    33    39    41   0.20000  1.0 3.0
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    39    41    42   0.41150 -1.0 2.0
   33    39    41    43   0.41150 -1.0 2.0
   33    39    44    45   0.06250  1.0 1.0
   33    39    44    45  -0.01100 -1.0 2.0
   33    39    44    45   0.28050  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41  -0.11250  1.0 3.0
   34    33    39    44   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41  -0.11250  1.0 3.0
   35    33    39    44   0.23400  1.0 3.0
   39    44    45    46   0.37050  1.0 3.0
   39    44    45    47   0.06250  1.0 1.0
   39    44    45    47  -0.01100 -1.0 2.0
   39    44    45    47   0.28050  1.0 3.0
   39    44    45    61  -0.12700  1.0 1.0
   39    44    45    61  -1.16200 -1.0 2.0
   39    44    45    61   0.58800  1.0 3.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    43   0.00000  1.0 1.0
   40    39    44    45   0.37050  1.0 3.0
   41    39    44    45  -1.11000  1.0 1.0
   41    39    44    45   0.50250 -1.0 2.0
   41    39    44    45   0.47450  1.0 3.0
   44    39    41    42   0.30150 -1.0 2.0
   44    39    41    43   0.30150 -1.0 2.0
   44    45    47    48   0.23400  1.0 3.0
   44    45    47    49   0.62750  1.0 1.0
   44    45    47    49  -0.30950 -1.0 2.0
   44    45    47    49   0.27300  1.0 3.0
   44    45    47    51   1.51850  1.0 1.0
   44    45    61    57  -0.70400  1.0 1.0
   44    45    61    57  -0.90350 -1.0 2.0
   45    47    49    50   0.15000  1.0 3.0
   45    47    49    53   0.56750  1.0 1.0
   45    47    49    53  -0.07550 -1.0 2.0
   45    47    49    53   0.20000  1.0 3.0
   45    47    49    55  -0.47750  1.0 1.0
   45    47    51    52   0.29150  1.0 1.0
   45    47    51    52  -0.28350 -1.0 2.0
   45    47    51    52   0.43600  1.0 3.0
   46    45    47    48   0.15000  1.0 3.0
   46    45    47    49   0.15000  1.0 3.0
   46    45    47    51   0.23400  1.0 3.0
   46    45    61    57   0.37050  1.0 3.0
   47    45    61    57   0.06250  1.0 1.0
   47    45    61    57  -0.01100 -1.0 2.0
   47    45    61    57   0.28050  1.0 3.0
   47    49    53    54   0.15000  1.0 3.0
   47    49   -53    57   0.56750  1.0 1.0
   47    49   -53    57  -0.07550 -1.0 2.0
   47    49   -53    57   0.20000  1.0 3.0
   47    49    53    59  -0.47750  1.0 1.0
   47    49    55    56   0.29150  1.0 1.0
   47    49    55    56  -0.28350 -1.0 2.0
   47    49    55    56   0.43600  1.0 3.0
   48    47    49    50   0.15000  1.0 3.0
   48    47    49    53   0.15000  1.0 3.0
   48    47    49    55   0.23400  1.0 3.0
   48    47    51    52   0.19450  1.0 3.0
   49    47    51    52   0.29150  1.0 1.0
   49    47    51    52  -0.28350 -1.0 2.0
   49    47    51    52   0.43600  1.0 3.0
   49    53    57    58   0.15000  1.0 3.0
   49    53    57    61   0.62750  1.0 1.0
   49    53    57    61  -0.30950 -1.0 2.0
   49    53    57    61   0.27300  1.0 3.0
   49    53    57    62   0.56750  1.0 1.0
   49    53    57    62  -0.07550 -1.0 2.0
   49    53    57    62   0.20000  1.0 3.0
   49    53    59    60   0.29150  1.0 1.0
   49    53    59    60  -0.28350 -1.0 2.0
   49    53    59    60   0.43600  1.0 3.0
   50    49    53    54   0.15000  1.0 3.0
   50    49    53    57   0.15000  1.0 3.0
   50    49    53    59   0.23400  1.0 3.0
   50    49    55    56   0.19450  1.0 3.0
   53    49    55    56   0.29150  1.0 1.0
   53    49    55    56  -0.28350 -1.0 2.0
   53    49    55    56   0.43600  1.0 3.0
   53    57   -61    45   0.06250  1.0 1.0
   53    57   -61    45  -0.01100 -1.0 2.0
   53    57   -61    45   0.28050  1.0 3.0
   53    57    62    63   0.15000  1.0 3.0
   53    57    62    64   0.15000  1.0 3.0
   53    57    62    65  -0.47750  1.0 1.0
   54    53    57    58   0.15000  1.0 3.0
   54    53    57    61   0.23400  1.0 3.0
   54    53    57    62   0.15000  1.0 3.0
   54    53    59    60   0.19450  1.0 3.0
   57    53    59    60   0.29150  1.0 1.0
   57    53    59    60  -0.28350 -1.0 2.0
   57    53    59    60   0.43600  1.0 3.0
   57    62    65    66   0.29150  1.0 1.0
   57    62    65    66  -0.28350 -1.0 2.0
   57    62    65    66   0.43600  1.0 3.0
   58    57    61    45   0.37050  1.0 3.0
   58    57    62    63   0.15000  1.0 3.0
   58    57    62    64   0.15000  1.0 3.0
   58    57    62    65   0.23400  1.0 3.0
   61    45    47    48   0.23400  1.0 3.0
   61    45   -47    49   0.62750  1.0 1.0
   61    45   -47    49  -0.30950 -1.0 2.0
   61    45   -47    49   0.27300  1.0 3.0
   61    45    47    51   1.51850  1.0 1.0
   61    57    62    63   0.23400  1.0 3.0
   61    57    62    64   0.23400  1.0 3.0
   61    57    62    65   1.51850  1.0 1.0
   62    57    61    45   0.06250  1.0 1.0
   62    57    61    45  -0.01100 -1.0 2.0
   62    57    61    45   0.28050  1.0 3.0
   63    62    65    66   0.19450  1.0 3.0
   64    62    65    66   0.19450  1.0 3.0
   59    53    57    58   0.23400  1.0 3.0
   59    53    57    61   1.51850  1.0 1.0
   59    53    57    62  -0.47750  1.0 1.0
   55    49    53    54   0.23400  1.0 3.0
   55    49    53    57  -0.47750  1.0 1.0
   55    49    53    59   3.77950  1.0 1.0
   51    47    49    50   0.23400  1.0 3.0
   51    47    49    53  -0.47750  1.0 1.0
   51    47    49    55   3.77950  1.0 1.0
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
   42    39    41    43  10.50000 -1.0 2.0
END
