* LIGAND DATABASE FILE (OPLS2005)
*
001      68    70    121    186     349
    1     0 S   NP   _N1_     1    29.99732    93.91929   -17.29058
    2     1 S   H    _HN1     2     1.02782    99.26742    -4.72858
    3     1 S   H    _H1_     3     1.02863   121.66931   113.40500
    4     1 S   H    _H2_     4     1.02835    14.99942   121.62483
    5     1 S   CT   _CA1     5     1.49876   104.68938  -121.15043
    6     5 S   HC   _HA1     6     1.09564   105.25208    43.10019
    7     5 S   CO3  _C1_     7     1.53814   112.17125   -77.31876
    8     7 S   O2Z  _O11     8     1.26383   115.04655   -48.44735
    9     7 S   O2Z  _O12     9     1.26221   114.91594   130.65067
   10     5 S   CT   _CB1    10     1.53098   107.64131   161.13756
   11    10 S   HC   HB11    11     1.09837   109.68940   -48.96616
   12    10 S   HC   HB12    12     1.09798   110.54947    67.53588
   13    10 S   CT   _CG1    13     1.53030   112.24847  -169.82589
   14    13 S   HC   HG11    14     1.09574   111.21791   -63.86943
   15    13 S   HC   HG12    15     1.09610   110.67759    55.23472
   16    13 S   C    _CD1    16     1.51356   110.34445   174.80544
   17    16 S   O    _OE1    17     1.22821   121.70860   -96.11137
   18    16 S   N    _N2_    18     1.38375   112.82071    82.45707
   19    18 S   H    _HN2    19     1.01587   119.08640     3.59358
   20    18 S   CT1  _CA2    20     1.46218   123.39472  -177.98481
   21    20 S   HC   _HA2    21     1.09734   109.40020    -2.62331
   22    20 S   C    _C2_    22     1.53399   108.78045  -118.36013
   23    22 S   O    _O2_    23     1.23062   122.31164  -146.94795
   24    20 S   CT   _CB2    32     1.53384   111.20035   119.22364
   25    24 S   HC   HB21    33     1.09430   109.45919    56.69044
   26    24 S   HC   HB22    34     1.09491   110.32300   175.52552
   27    22 S   N    _N3_    24     1.38359   113.68506    40.67705
   28    27 S   H    _HN3    25     1.01630   119.66072    -3.93846
   29    24 S   S    _SG2    35     1.82871   111.25500   -64.73120
   30    27 S   CT   _CA3    26     1.45308   122.87249   176.74689
   31    30 S   HC   HA31    27     1.09561   107.62786   -60.65043
   32    30 S   HC   HA32    28     1.09564   107.78872    55.67985
   33    29 S   CT   _C17    36     1.85697   100.33509   169.17151
   34    30 S   CO3  _C3_    29     1.52881   114.31822   177.61116
   35    34 S   O2Z  _O31    30     1.26329   116.09369    -0.12667
   36    34 S   O2Z  _O32    31     1.26446   114.38682   179.87967
   37    33 S   CM   _C14    37     1.50038   106.85210   170.39622
   38    37 S   HC   _H27    38     1.09223   114.55415   -91.37171
   39    33 S   OS   _O21    64     1.42783   109.33116    49.44051
   40    37 S   CMA  _C15    39     1.35498   127.88914    93.54505
   41    40 S   OM   _O17    40     1.26524   123.93415   170.23749
   42    39 S   CT   _C19    65     1.42300   116.56760   176.27038
   43    42 S   HC   _H31    66     1.09378   107.78136   173.40873
   44    42 S   HC   _H32    67     1.09277   111.99652    54.67503
   45    42 S   HC   _H33    68     1.09339   111.07856   -68.79993
   46    40 S   CA   _C11    41     1.53058   114.41420    -7.97853
   47    46 S   CA   _C8_    42     1.44817   123.91901  -155.91202
   48    46 S   CA   _C10    54     1.41110   118.39428    26.55344
   49    47 S   CA   _C5_    43     1.42310   124.90213    11.31717
   50    49 S   HA   _H24    44     1.08652   121.02589     2.58005
   51    33 S   CO4  _C16    55     1.52642   107.42984   -72.38580
   52    51 S   O    _O18    56     1.22845   123.21325    97.62186
   53    49 S   CA   _C7_    45     1.39804   123.44617  -179.84934
   54    53 S   HA   _H26    46     1.08617   119.25447  -179.38229
   55    53 S   CA   _C12    47     1.38136   119.48720    -0.24066
   56    55 S   CA   _C13    48     1.39298   119.68139     0.02798
   57    55 S   OH   _O19    62     1.36626   120.48552  -178.52847
   58    57 S   HO   _H34    63     0.97245   108.78737    -2.56468
   59    47 S   CA   _C9_    49     1.42706   119.38952  -170.69002
   60    56 S   OS   _O20    57     1.37802   118.73790  -176.69779
   61    59 S   CA   _C4_    50     1.40426   119.42949    -3.09244
   62    61 S   HA   _H23    51     1.08873   120.98195  -179.07507
   63    60 S   CT   _C18    58     1.42920   110.22339   -85.75488
   64    63 S   HC   _H28    59     1.09407   107.73147  -174.37747
   65    63 S   HC   _H29    60     1.09484   111.29511    67.43279
   66    63 S   HC   _H30    61     1.09571   111.44569   -56.07488
   67    61 S   CA   _C6_    52     1.38542   121.39544    -1.71600
   68    67 S   HA   _H25    53     1.08693   118.84133  -176.36719
  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   9   5   4   3
  14   2   1   1  10   5   8   8   3   4   2   1   1  12  13   8
   8   4   4   1   7   3   7  11   3   1   6   5   3   2   3   2
   1   1   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    51    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    48    51    52    39    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    41    46    67    48    51    52    39    42    43    44    45  
   35    36  
   36  
    0  
   38    40    41    46    47    48    51    52    39    42  
   40    41    46    51    39  
   42    43    44    45    40    48    51    52  
   41    46    47    49    59    67    48    51  
   46    47    48  
   43    44    45    51  
   44    45  
   45  
    0  
   47    49    50    53    56    59    61    67    68    48    51    52  
   49    50    53    54    55    56    59    61    62    67    48    51    60  
   51    52    49    59    61    62    67    68  
   50    53    54    55    56    59    61    57  
   53    54    55    59  
   52    61    67    68  
   67  
   54    55    56    59    60    57    58  
   55    56    57  
   56    59    61    60    63    57    58  
   59    61    62    67    60    63    64    65    66    57    58  
   58    59    60  
    0  
   61    62    67    68    60    63  
   63    64    65    66    61  
   62    67    68  
   67    68  
   64    65    66  
   65    66  
   66  
    0  
   68  
    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  -0.316400   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   0.465900   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.785200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   40   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.7500   0.1050   0.537000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   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   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   56   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   58   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   59   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   60   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   68   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   317.000  1.510
   33    51   317.000  1.522
   33    39   320.000  1.410
   37    38   340.000  1.080
   37    40   465.000  1.376
   40    41   745.000  1.250
   40    46   320.000  1.460
   46    47   469.000  1.400
   46    48   469.000  1.400
   47    49   469.000  1.400
   47    59   469.000  1.400
   49    50   367.000  1.080
   49    53   469.000  1.400
   53    54   367.000  1.080
   53    55   469.000  1.400
   55    56   469.000  1.400
   55    57   450.000  1.364
   56    59   469.000  1.400
   56    60   450.000  1.364
   59    61   469.000  1.400
   61    62   367.000  1.080
   61    67   469.000  1.400
   67    68   367.000  1.080
   67    48   469.000  1.400
   48    51   310.000  1.470
   51    52   570.000  1.229
   60    63   320.000  1.410
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   57    58   553.000  0.945
   39    42   320.000  1.410
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    51    75.00000  110.18000
   29    33    39    85.00000  114.68000
   33    37    38    35.00000  117.00000
   33    37    40    70.00000  124.00000
   33    51    48    65.00000  115.47100
   33    51    52    80.00000  120.40000
   33    39    42    60.00000  109.50000
   37    40    41    65.00000  137.10300
   37    40    46    60.00000  123.20500
   40    37    38    40.00000  120.50800
   40    46    47    60.00000  120.93500
   40    46    48    60.00000  120.93500
   46    40    41    85.00000  114.86500
   46    47    49    63.00000  120.00000
   46    47    59    63.00000  120.00000
   46    48    67    63.00000  120.00000
   46    48    51    60.00000  119.52600
   47    49    50    35.00000  120.00000
   47    49    53    63.00000  120.00000
   47    59    56    63.00000  120.00000
   47    59    61    63.00000  120.00000
   49    53    54    35.00000  120.00000
   49    53    55    63.00000  120.00000
   53    49    50    35.00000  120.00000
   53    55    56    63.00000  120.00000
   53    55    57    70.00000  120.00000
   55    53    54    35.00000  120.00000
   55    56    59    63.00000  120.00000
   55    56    60    70.00000  120.00000
   55    57    58    35.00000  113.00000
   56    59    61    63.00000  120.00000
   56    60    63    75.00000  111.00000
   59    47    49    63.00000  120.00000
   59    61    62    35.00000  120.00000
   59    61    67    63.00000  120.00000
   61    67    68    35.00000  120.00000
   61    67    48    63.00000  120.00000
   67    61    62    35.00000  120.00000
   67    48    51    60.00000  119.52600
   48    46    47    63.00000  120.00000
   48    67    68    35.00000  120.00000
   48    51    52    75.00000  123.78400
   51    33    37    70.00000  109.06800
   60    56    59    70.00000  120.00000
   60    63    64    35.00000  109.50000
   60    63    65    35.00000  109.50000
   60    63    66    35.00000  109.50000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   57    55    56    70.00000  120.00000
   39    33    37    85.00000  110.90400
   39    33    51    90.00000  108.74100
   39    42    43    35.00000  109.50000
   39    42    44    35.00000  109.50000
   39    42    45    35.00000  109.50000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    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    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    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   0.21350  1.0 3.0
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.00000  1.0 1.0
   29    33    37    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    51    48   0.65300  1.0 1.0
   29    33    51    48  -0.03850 -1.0 2.0
   29    33    51    48   0.33900  1.0 3.0
   29    33    51    52   0.30150 -1.0 2.0
   29    33    39    42   0.14700  1.0 1.0
   29    33    39    42  -1.16150 -1.0 2.0
   29    33    39    42   0.48700  1.0 3.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37    40    46   7.00000 -1.0 2.0
   33    39    42    43   0.37050  1.0 3.0
   33    39    42    44   0.37050  1.0 3.0
   33    39    42    45   0.37050  1.0 3.0
   37    33    51    48   0.65300  1.0 1.0
   37    33    51    48  -0.03850 -1.0 2.0
   37    33    51    48   0.33900  1.0 3.0
   37    33    51    52   0.30150 -1.0 2.0
   37    33    39    42  -0.77900  1.0 1.0
   37    33    39    42  -0.36900 -1.0 2.0
   37    33    39    42   0.40400  1.0 3.0
   37    40    46    47   0.15800  1.0 1.0
   37    40    46    47   1.85350 -1.0 2.0
   37    40    46    47  -0.48700  1.0 3.0
   37    40   -46    48   0.15800  1.0 1.0
   37    40   -46    48   1.85350 -1.0 2.0
   37    40   -46    48  -0.48700  1.0 3.0
   38    37    40    41   7.00000 -1.0 2.0
   38    37    40    46   7.00000 -1.0 2.0
   40    46    47    49   3.62500 -1.0 2.0
   40    46    47    59   3.62500 -1.0 2.0
   40    46    48    67   3.62500 -1.0 2.0
   40    46    48    51   3.62500 -1.0 2.0
   41    40    46    47  -0.01750  1.0 1.0
   41    40    46    47  -0.32000 -1.0 2.0
   41    40    46    47   0.00600  1.0 3.0
   41    40    46    48  -0.01750  1.0 1.0
   41    40    46    48  -0.32000 -1.0 2.0
   41    40    46    48   0.00600  1.0 3.0
   46    47    49    50   3.62500 -1.0 2.0
   46    47    49    53   3.62500 -1.0 2.0
   46    47    59    56   3.62500 -1.0 2.0
   46    47    59    61   3.62500 -1.0 2.0
   46    48   -51    33   2.26350  1.0 1.0
   46    48   -51    33   0.76750 -1.0 2.0
   46    48   -51    33   0.22500  1.0 3.0
   46    48    51    52   1.05000 -1.0 2.0
   47    46    48    67   3.62500 -1.0 2.0
   47    46    48    51   3.62500 -1.0 2.0
   47    49    53    54   3.62500 -1.0 2.0
   47    49    53    55   3.62500 -1.0 2.0
   47    59    61    62   3.62500 -1.0 2.0
   47    59   -61    67   3.62500 -1.0 2.0
   49    47    59    56   3.62500 -1.0 2.0
   49    47    59    61   3.62500 -1.0 2.0
   49    53   -55    56   3.62500 -1.0 2.0
   49    53    55    57   3.62500 -1.0 2.0
   50    49    53    54   3.62500 -1.0 2.0
   50    49    53    55   3.62500 -1.0 2.0
   53    55    56    59   3.62500 -1.0 2.0
   53    55    56    60   3.62500 -1.0 2.0
   53    55    57    58   0.84100 -1.0 2.0
   54    53    55    56   3.62500 -1.0 2.0
   54    53    55    57   3.62500 -1.0 2.0
   55    56   -59    47   3.62500 -1.0 2.0
   55    56    59    61   3.62500 -1.0 2.0
   55    56    60    63   1.63200 -1.0 2.0
   56    55    57    58   0.84100 -1.0 2.0
   56    59    61    62   3.62500 -1.0 2.0
   56    59    61    67   3.62500 -1.0 2.0
   56    60    63    64   0.08050  1.0 3.0
   56    60    63    65   0.08050  1.0 3.0
   56    60    63    66   0.08050  1.0 3.0
   59    47    49    50   3.62500 -1.0 2.0
   59    47   -49    53   3.62500 -1.0 2.0
   59    56    60    63   1.63200 -1.0 2.0
   59    61    67    68   3.62500 -1.0 2.0
   59    61    67    48   3.62500 -1.0 2.0
   61    67   -48    46   3.62500 -1.0 2.0
   61    67    48    51   3.62500 -1.0 2.0
   62    61    67    68   3.62500 -1.0 2.0
   62    61    67    48   3.62500 -1.0 2.0
   67    48    51    33   2.26350  1.0 1.0
   67    48    51    33   0.76750 -1.0 2.0
   67    48    51    33   0.22500  1.0 3.0
   67    48    51    52   1.05000 -1.0 2.0
   68    67    48    46   3.62500 -1.0 2.0
   68    67    48    51   3.62500 -1.0 2.0
   48    46    47    49   3.62500 -1.0 2.0
   48    46   -47    59   3.62500 -1.0 2.0
   51    33    37    38   0.00000  1.0 1.0
   51    33   -37    40  -0.51250  1.0 1.0
   51    33   -37    40  -0.88800 -1.0 2.0
   51    33   -37    40   0.08850  1.0 3.0
   51    33    39    42  -1.11000  1.0 1.0
   51    33    39    42   0.50250 -1.0 2.0
   51    33    39    42   0.47450  1.0 3.0
   60    56    59    47   3.62500 -1.0 2.0
   60    56    59    61   3.62500 -1.0 2.0
   57    55    56    59   3.62500 -1.0 2.0
   57    55    56    60   3.62500 -1.0 2.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    40   0.39000  1.0 1.0
   39    33    37    40  -0.05800 -1.0 2.0
   39    33    37    40  -0.55150  1.0 3.0
   39    33    51    48   0.65300  1.0 1.0
   39    33    51    48  -0.03850 -1.0 2.0
   39    33    51    48   0.33900  1.0 3.0
   39    33    51    52   0.30150 -1.0 2.0
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
   36    30    34    35  10.50000 -1.0 2.0
   33    38    37    40   1.10000 -1.0 2.0
   46    41    40    37   1.10000 -1.0 2.0
   47    48    46    40   4.00000 -1.0 2.0
   49    59    47    46   4.00000 -1.0 2.0
   53    50    49    47   1.10000 -1.0 2.0
   55    54    53    49   1.10000 -1.0 2.0
   56    57    55    53   4.00000 -1.0 2.0
   59    60    56    55   4.00000 -1.0 2.0
   56    61    59    47   4.00000 -1.0 2.0
   67    62    61    59   1.10000 -1.0 2.0
   48    68    67    61   1.10000 -1.0 2.0
   67    51    48    46   4.00000 -1.0 2.0
   33    48    51    52  10.50000 -1.0 2.0
END
