* LIGAND DATABASE FILE (OPLS2005)
*
001      71    72    126    195     370
    1     0 S   NP   _N1_     1    28.66326    95.43032   -23.48244
    2     1 S   H    _HN1     2     1.02787   104.62912   -93.11576
    3     1 S   H    _H1_     3     1.02949    77.28932    12.84598
    4     1 S   H    _H2_     4     1.02827    33.15922   166.45561
    5     1 S   CT   _CA1     5     1.50117   136.66376   119.20076
    6     5 S   HC   _HA1     6     1.09573   105.18949    84.69529
    7     5 S   CO3  _C1_     7     1.53783   112.47008   -35.54464
    8     7 S   O2Z  _O11     8     1.26373   115.00772   -42.43809
    9     7 S   O2Z  _O12     9     1.26239   114.94530   136.68142
   10     5 S   CT   _CB1    10     1.53074   107.41685  -157.31543
   11    10 S   HC   HB11    11     1.09835   109.36742   -49.58328
   12    10 S   HC   HB12    12     1.09812   110.45043    67.02206
   13    10 S   CT   _CG1    13     1.52997   112.61622  -170.54751
   14    13 S   HC   HG11    14     1.09578   110.66104   -65.98073
   15    13 S   HC   HG12    15     1.09670   109.76379    53.25979
   16    13 S   C    _CD1    16     1.51800   112.16804   173.72699
   17    16 S   O    _OE1    17     1.22737   123.25790     8.27768
   18    16 S   N    _N2_    18     1.38638   111.70898  -171.79436
   19    18 S   H    _HN2    19     1.01577   118.96442     1.58016
   20    18 S   CT1  _CA2    20     1.46244   123.42433   177.41207
   21    20 S   HC   _HA2    21     1.09735   109.36314     4.77372
   22    20 S   C    _C2_    22     1.53601   108.56571  -110.73100
   23    22 S   O    _O2_    23     1.23051   122.33192  -147.50545
   24    20 S   CT   _CB2    32     1.53419   111.53960   126.78960
   25    24 S   HC   HB21    33     1.09478   109.55268    56.85881
   26    24 S   HC   HB22    34     1.09432   109.80045   175.71669
   27    22 S   N    _N3_    24     1.38350   113.73312    39.92431
   28    27 S   H    _HN3    25     1.01564   119.60007    -3.17620
   29    24 S   S    _SG2    35     1.83280   111.11410   -64.31741
   30    27 S   CT   _CA3    26     1.45282   123.22595   177.22244
   31    30 S   HC   HA31    27     1.09548   107.49845   -64.99891
   32    30 S   HC   HA32    28     1.09556   108.00599    51.45044
   33    29 S   CT   _C15    36     1.86430   101.34632   176.18310
   34    30 S   CO3  _C3_    29     1.52967   114.06537   173.45471
   35    34 S   O2Z  _O31    30     1.26378   116.07129    -0.72416
   36    34 S   O2Z  _O32    31     1.26427   114.41434   179.34062
   37    33 S   CM   _C10    37     1.49155   108.29165    63.17642
   38    37 S   HC   _H24    38     1.09386   114.16667    58.38635
   39    33 S   CT   _C19    55     1.55173   106.70322  -177.44044
   40    39 S   HC   _H34    56     1.10007   109.78920   -58.07444
   41    39 S   HC   _H35    57     1.09984   109.93200    58.51956
   42    37 S   CMA  _C11    39     1.35027   129.07197  -122.45690
   43    42 S   OM   _O17    40     1.26682   123.60584  -179.69610
   44    39 S   CT   _C18    58     1.53824   114.13988  -179.81977
   45    44 S   HC   _H32    59     1.09347   110.98728    56.59303
   46    44 S   HC   _H33    60     1.09659   110.14447   -60.24232
   47    42 S   CA   _C6_    41     1.52244   115.03457     0.16432
   48    44 S   CM   _C13    61     1.50401   111.00580  -179.30451
   49    48 S   HC   _H25    62     1.08937   114.24255    78.29556
   50    47 S   CA   _C7_    42     1.41549   122.32473     1.54952
   51    48 S   CM   _C14    63     1.34661   127.47472  -102.70057
   52    50 S   CA   _C9_    43     1.41471   120.57761   179.70459
   53    33 S   CO4  _C12    53     1.51812   107.50583   -60.49879
   54    53 S   O    _O18    54     1.23122   121.20973   -57.03141
   55    51 S   CT   _C16    64     1.50529   120.53900  -178.38408
   56    55 S   HC   _H26    65     1.09497   110.20170   121.08374
   57    55 S   HC   _H27    66     1.09494   110.29249  -119.09458
   58    55 S   HC   _H28    67     1.09512   112.39785     1.04193
   59    51 S   CT   _C17    68     1.50289   124.97056     2.32229
   60    59 S   HC   _H29    69     1.09545   110.05360   127.22383
   61    59 S   HC   _H30    70     1.09477   110.10444  -113.45934
   62    59 S   HC   _H31    71     1.09242   113.46927     7.72151
   63    52 S   CA   _C5_    44     1.39042   121.32388     0.11535
   64    63 S   HA   _H23    45     1.08627   120.68575   179.95577
   65    52 S   OH   _O20    51     1.37148   123.95829  -179.97202
   66    65 S   HO   _H37    52     0.97330   109.00692     0.42978
   67    63 S   CA   _C4_    46     1.38282   119.38927    -0.00000
   68    67 S   HA   _H22    47     1.08671   119.78077   179.97202
   69    47 S   CA   _C8_    48     1.42387   121.64132  -178.61492
   70    69 S   OH   _O19    49     1.37519   123.49393     0.26761
   71    70 S   HO   _H36    50     0.97530   107.48610    -0.56163
  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  11   5   4   3
  16   2   1   1  12   5  12   6   5   8   3   8   4   3  11  10
   3  10   8   9   4   1   7   3   2   1   3   2   1   1   7   4
   2   1   4   2   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    53    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    50    53    54    39    40    41    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    47    50    52    53    54    39    40    41    44    45    46    48  
   35    36  
   36  
    0  
   38    42    43    47    50    69    53    54    39    40    41    44  
   42    43    47    53    39  
   40    41    44    45    46    48    49    51    42    50    53    54  
   41    44    45    46    48    53  
   44    45    46    48    53  
   43    47    50    52    67    69    70    53  
   47    50    69  
   45    46    48    49    51    55    59    53  
   46    48    49    51  
   48    49    51  
   50    52    63    67    68    69    70    71    65    53    54  
   49    51    55    56    57    58    59    60    61    62  
   51    55    59  
   52    63    64    67    69    70    65    66    53    54  
   55    56    57    58    59    60    61    62  
   63    64    67    68    69    65    66    53    54  
   54    63    65    69  
    0  
   56    57    58    59    60    61    62  
   57    58    59  
   58    59  
   59  
   60    61    62  
   61    62  
   62  
    0  
   64    67    68    69    70    65    66  
   67    68    69    65  
   66    67  
    0  
   68    69    70    71  
   69    70  
   70    71  
   71  
    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   0.167500   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  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   52   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   53   3.7500   0.1050   0.585000   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   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
   69   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   70   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.435000   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    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    53   317.000  1.522
   33    39   268.000  1.529
   37    38   340.000  1.080
   37    42   465.000  1.376
   42    43   745.000  1.250
   42    47   320.000  1.460
   47    50   469.000  1.400
   47    69   469.000  1.400
   50    52   469.000  1.400
   50    53   310.000  1.470
   52    63   469.000  1.400
   52    65   450.000  1.364
   63    64   367.000  1.080
   63    67   469.000  1.400
   67    68   367.000  1.080
   67    69   469.000  1.400
   69    70   450.000  1.364
   70    71   553.000  0.945
   65    66   553.000  0.945
   53    54   570.000  1.229
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    48   317.000  1.510
   48    49   340.000  1.080
   48    51   549.000  1.340
   51    55   317.000  1.510
   51    59   317.000  1.510
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   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    53    75.00000  110.18000
   29    33    39    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    42    70.00000  124.00000
   33    53    50    65.00000  115.47100
   33    53    54    80.00000  120.40000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    44    58.35000  112.70000
   37    42    43    65.00000  137.10300
   37    42    47    60.00000  123.20500
   42    37    38    40.00000  120.50800
   42    47    50    60.00000  120.93500
   42    47    69    60.00000  120.93500
   47    42    43    85.00000  114.86500
   47    50    52    63.00000  120.00000
   47    50    53    60.00000  119.52600
   47    69    67    63.00000  120.00000
   47    69    70    70.00000  120.00000
   50    52    63    63.00000  120.00000
   50    52    65    70.00000  120.00000
   50    53    54    75.00000  123.78400
   52    63    64    35.00000  120.00000
   52    63    67    63.00000  120.00000
   52    65    66    35.00000  113.00000
   63    67    68    35.00000  120.00000
   63    67    69    63.00000  120.00000
   67    63    64    35.00000  120.00000
   67    69    70    70.00000  120.00000
   69    47    50    63.00000  120.00000
   69    67    68    35.00000  120.00000
   69    70    71    35.00000  113.00000
   65    52    63    70.00000  120.00000
   53    33    37    70.00000  109.06800
   53    50    52    60.00000  119.52600
   39    33    37    70.00000  112.02700
   39    33    53    63.00000  111.10000
   39    44    45    37.50000  110.70000
   39    44    46    37.50000  110.70000
   39    44    48    70.00000  112.02700
   41    39    40    33.00000  107.80000
   44    39    40    37.50000  110.70000
   44    39    41    37.50000  110.70000
   44    48    49    35.00000  117.00000
   44    48    51    70.00000  124.00000
   46    44    45    33.00000  107.80000
   48    44    45    35.00000  109.50000
   48    44    46    35.00000  109.50000
   48    51    55    70.00000  124.00000
   48    51    59    70.00000  124.00000
   51    48    49    35.00000  120.00000
   51    55    56    35.00000  109.50000
   51    55    57    35.00000  109.50000
   51    55    58    35.00000  109.50000
   51    59    60    35.00000  109.50000
   51    59    61    35.00000  109.50000
   51    59    62    35.00000  109.50000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   59    51    55    65.00000  117.92700
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    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    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
   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    37    38   0.00000  1.0 1.0
   29    33    37    42   0.42700  1.0 1.0
   29    33    37    42  -0.70350 -1.0 2.0
   29    33    37    42  -0.43150  1.0 3.0
   29    33    53    50   0.65300  1.0 1.0
   29    33    53    50  -0.03850 -1.0 2.0
   29    33    53    50   0.33900  1.0 3.0
   29    33    53    54   0.30150 -1.0 2.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    44   0.44750  1.0 1.0
   29    33    39    44  -0.17800 -1.0 2.0
   29    33    39    44   0.20200  1.0 3.0
   33    37    42    43   7.00000 -1.0 2.0
   33    37    42    47   7.00000 -1.0 2.0
   33    39    44    45   0.15000  1.0 3.0
   33    39    44    46   0.15000  1.0 3.0
   33    39    44    48   0.34400  1.0 1.0
   33    39    44    48   0.09450 -1.0 2.0
   33    39    44    48   0.11100  1.0 3.0
   37    33    53    50   0.65300  1.0 1.0
   37    33    53    50  -0.03850 -1.0 2.0
   37    33    53    50   0.33900  1.0 3.0
   37    33    53    54   0.30150 -1.0 2.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    33    39    44   0.34400  1.0 1.0
   37    33    39    44   0.09450 -1.0 2.0
   37    33    39    44   0.11100  1.0 3.0
   37    42   -47    50   0.15800  1.0 1.0
   37    42   -47    50   1.85350 -1.0 2.0
   37    42   -47    50  -0.48700  1.0 3.0
   37    42    47    69   0.15800  1.0 1.0
   37    42    47    69   1.85350 -1.0 2.0
   37    42    47    69  -0.48700  1.0 3.0
   38    37    42    43   7.00000 -1.0 2.0
   38    37    42    47   7.00000 -1.0 2.0
   42    47    50    52   3.62500 -1.0 2.0
   42    47    50    53   3.62500 -1.0 2.0
   42    47    69    67   3.62500 -1.0 2.0
   42    47    69    70   3.62500 -1.0 2.0
   43    42    47    50  -0.01750  1.0 1.0
   43    42    47    50  -0.32000 -1.0 2.0
   43    42    47    50   0.00600  1.0 3.0
   43    42    47    69  -0.01750  1.0 1.0
   43    42    47    69  -0.32000 -1.0 2.0
   43    42    47    69   0.00600  1.0 3.0
   47    50    52    63   3.62500 -1.0 2.0
   47    50    52    65   3.62500 -1.0 2.0
   47    50   -53    33   2.26350  1.0 1.0
   47    50   -53    33   0.76750 -1.0 2.0
   47    50   -53    33   0.22500  1.0 3.0
   47    50    53    54   1.05000 -1.0 2.0
   47    69    70    71   0.84100 -1.0 2.0
   50    47    69    67   3.62500 -1.0 2.0
   50    47    69    70   3.62500 -1.0 2.0
   50    52    63    64   3.62500 -1.0 2.0
   50    52   -63    67   3.62500 -1.0 2.0
   50    52    65    66   0.84100 -1.0 2.0
   52    50    53    33   2.26350  1.0 1.0
   52    50    53    33   0.76750 -1.0 2.0
   52    50    53    33   0.22500  1.0 3.0
   52    50    53    54   1.05000 -1.0 2.0
   52    63    67    68   3.62500 -1.0 2.0
   52    63    67    69   3.62500 -1.0 2.0
   63    52    65    66   0.84100 -1.0 2.0
   63    67   -69    47   3.62500 -1.0 2.0
   63    67    69    70   3.62500 -1.0 2.0
   64    63    67    68   3.62500 -1.0 2.0
   64    63    67    69   3.62500 -1.0 2.0
   67    69    70    71   0.84100 -1.0 2.0
   68    67    69    47   3.62500 -1.0 2.0
   68    67    69    70   3.62500 -1.0 2.0
   69    47   -50    52   3.62500 -1.0 2.0
   69    47    50    53   3.62500 -1.0 2.0
   65    52    63    64   3.62500 -1.0 2.0
   65    52    63    67   3.62500 -1.0 2.0
   53    33    37    38   0.00000  1.0 1.0
   53    33   -37    42  -0.51250  1.0 1.0
   53    33   -37    42  -0.88800 -1.0 2.0
   53    33   -37    42   0.08850  1.0 3.0
   53    33    39    40  -0.11250  1.0 3.0
   53    33    39    41  -0.11250  1.0 3.0
   53    33    39    44  -0.95700  1.0 1.0
   53    33    39    44  -0.18200 -1.0 2.0
   53    33    39    44   0.29450  1.0 3.0
   53    50    52    63   3.62500 -1.0 2.0
   53    50    52    65   3.62500 -1.0 2.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    42   0.09850  1.0 1.0
   39    33    37    42   0.15250 -1.0 2.0
   39    33    37    42  -0.50650  1.0 3.0
   39    33    53    50   0.05850 -1.0 2.0
   39    33    53    50   0.17250  1.0 3.0
   39    33    53    54   0.30150 -1.0 2.0
   39    44    48    49   0.00000  1.0 1.0
   39    44    48    51   0.09850  1.0 1.0
   39    44    48    51   0.15250 -1.0 2.0
   39    44    48    51  -0.50650  1.0 3.0
   40    39    44    45   0.15000  1.0 3.0
   40    39    44    46   0.15000  1.0 3.0
   40    39    44    48   0.15000  1.0 3.0
   41    39    44    45   0.15000  1.0 3.0
   41    39    44    46   0.15000  1.0 3.0
   41    39    44    48   0.15000  1.0 3.0
   44    48    51    55   7.00000 -1.0 2.0
   44    48    51    59   7.00000 -1.0 2.0
   45    44    48    49   0.33100  1.0 3.0
   45    44    48    51   0.00000  1.0 1.0
   46    44    48    49   0.33100  1.0 3.0
   46    44    48    51   0.00000  1.0 1.0
   48    51    55    56   0.00000  1.0 1.0
   48    51    55    57   0.00000  1.0 1.0
   48    51    55    58   0.00000  1.0 1.0
   48    51    59    60   0.00000  1.0 1.0
   48    51    59    61   0.00000  1.0 1.0
   48    51    59    62   0.00000  1.0 1.0
   49    48    51    55   7.00000 -1.0 2.0
   49    48    51    59   7.00000 -1.0 2.0
   55    51    59    60   0.34800  1.0 3.0
   55    51    59    61   0.34800  1.0 3.0
   55    51    59    62   0.34800  1.0 3.0
   59    51    55    56   0.34800  1.0 3.0
   59    51    55    57   0.34800  1.0 3.0
   59    51    55    58   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
   36    30    34    35  10.50000 -1.0 2.0
   33    38    37    42   1.10000 -1.0 2.0
   47    43    42    37   1.10000 -1.0 2.0
   50    69    47    42   4.00000 -1.0 2.0
   52    53    50    47   4.00000 -1.0 2.0
   63    65    52    50   4.00000 -1.0 2.0
   67    64    63    52   1.10000 -1.0 2.0
   69    68    67    63   1.10000 -1.0 2.0
   67    70    69    47   4.00000 -1.0 2.0
   33    50    53    54  10.50000 -1.0 2.0
   44    49    48    51  15.00000 -1.0 2.0
   55    59    51    48  15.00000 -1.0 2.0
END
