* LIGAND DATABASE FILE (OPLS2005)
*
001      72    73    131    194     375
    1     0 S   NP   _N1_     1    28.83478    97.06149   -23.31356
    2     1 S   H    _HN1     2     1.02948    68.36902     6.60295
    3     1 S   H    _H1_     3     1.02828    41.42422   164.58915
    4     1 S   H    _H2_     4     1.02788   106.62701   -97.00935
    5     1 S   CT   _CA1     5     1.50115   138.74512   103.29921
    6     5 S   HC   _HA1     6     1.09573   105.18643    97.61470
    7     5 S   CO3  _C1_     7     1.53779   112.46848   -22.61481
    8     7 S   O2Z  _O11     8     1.26372   115.00575   -42.62009
    9     7 S   O2Z  _O12     9     1.26239   114.94180   136.48247
   10     5 S   CT   _CB1    10     1.53072   107.41598  -144.40989
   11    10 S   HC   HB11    11     1.09835   109.35220   -49.69594
   12    10 S   HC   HB12    12     1.09812   110.46057    66.90705
   13    10 S   CT   _CG1    13     1.52997   112.61476  -170.66247
   14    13 S   HC   HG11    14     1.09578   110.66071   -66.20582
   15    13 S   HC   HG12    15     1.09671   109.75720    53.03204
   16    13 S   C    _CD1    16     1.51803   112.16445   173.48585
   17    16 S   O    _OE1    17     1.22736   123.25637     8.43294
   18    16 S   N    _N2_    18     1.38657   111.71590  -171.58767
   19    18 S   H    _HN2    19     1.01572   118.93382     1.63423
   20    18 S   CT1  _CA2    20     1.46225   123.40228   177.14933
   21    20 S   HC   _HA2    21     1.09736   109.34182     5.16012
   22    20 S   C    _C2_    22     1.53611   108.58698  -110.32865
   23    22 S   O    _O2_    23     1.23062   122.30555  -147.33452
   24    20 S   CT   _CB2    32     1.53346   111.63045   127.17740
   25    24 S   HC   HB21    33     1.09591   110.09669    56.46995
   26    24 S   HC   HB22    34     1.09452   110.00134   175.50037
   27    22 S   N    _N3_    24     1.38336   113.74864    40.06234
   28    27 S   H    _HN3    25     1.01566   119.60805    -3.09364
   29    24 S   S    _SG2    35     1.82763   111.53254   -64.33164
   30    27 S   CT   _CA3    26     1.45289   123.25051   177.24487
   31    30 S   HC   HA31    27     1.09547   107.49274   -65.18251
   32    30 S   HC   HA32    28     1.09556   108.01369    51.27177
   33    29 S   CT   _C15    36     1.83028    99.56787   175.96318
   34    33 S   HC   _H3_    37     1.09608   110.06180   -40.71845
   35    30 S   CO3  _C3_    29     1.52971   114.05576   173.28291
   36    35 S   O2Z  _O31    30     1.26380   116.06696    -0.66558
   37    35 S   O2Z  _O32    31     1.26426   114.41632   179.39899
   38    33 S   CM   _C5_    38     1.49406   110.02174    79.49598
   39    38 S   HC   _H22    39     1.08927   116.71031   -65.64543
   40    38 S   CMA  _C8_    40     1.34514   125.02585   116.01390
   41    40 S   OM   _O17    41     1.25934   130.48788   179.29169
   42    40 S   CM   _C4_    42     1.45844   118.07798    -0.59413
   43    42 S   HC   _H21    43     1.09052   116.96530  -177.13611
   44    42 S   CM   _C7_    44     1.34509   125.14959     4.22225
   45    33 S   CO4  _C10    45     1.52545   107.41831  -156.32762
   46    45 S   O    _O18    46     1.23363   120.71627    64.18883
   47    44 S   CT   _C14    47     1.51182   125.07266   179.07001
   48    47 S   HC   _H27    48     1.09567   110.26826   134.39349
   49    47 S   CM   _C6_    49     1.49007   112.48658  -101.50595
   50    49 S   HC   _H23    50     1.08056   124.54886   -61.63601
   51    49 S   CM   _C9_    51     1.33266   110.28279   117.15948
   52    51 S   CT   _C13    52     1.48419   109.62785     1.52521
   53    52 S   HC   _H25    53     1.09376   112.06715   120.11790
   54    52 S   HC   _H26    54     1.09317   112.40047  -116.06890
   55    51 S   CT   _C18    56     1.49304   127.35815  -178.42903
   56    55 S   HC   _H35    57     1.09693   108.77507  -127.69503
   57    55 S   HC   _H36    58     1.09797   109.93603   -12.01157
   58    47 S   OS   _O19    55     1.44721   111.69439    16.34994
   59    55 S   CT   _C19    59     1.53478   113.42346   110.73605
   60    59 S   HC   _H37    60     1.09329   109.88750    61.70045
   61    59 S   HC   _H38    61     1.09731   108.44006   176.79264
   62    59 S   CM   _C11    62     1.50557   112.30866   -64.42141
   63    62 S   HC   _H24    63     1.08979   113.88962   -63.50217
   64    62 S   CM   _C12    64     1.34685   128.25766   116.06781
   65    64 S   CT   _C16    65     1.50623   120.33373  -178.94687
   66    65 S   HC   _H29    66     1.09513   110.20701   119.66574
   67    65 S   HC   _H30    67     1.09509   112.44029    -0.37587
   68    65 S   HC   _H31    68     1.09493   110.26126  -120.50790
   69    64 S   CT   _C17    69     1.50241   125.59053     0.43115
   70    69 S   HC   _H32    70     1.09518   109.98937   120.71279
   71    69 S   HC   _H33    71     1.09455   110.08507  -120.11503
   72    69 S   HC   _H34    72     1.09109   113.81008     0.35388
  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
  10   6   2   1   1   8   4   6   3   8   3   9   5   1   9   5
  10   4  11   7   3   2   9   5   4   1   7   4   3  10   3   8
   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    45    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    45    46  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    44    45    46    47  
   38    39    40    44    45    46  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45    46  
   40    41    42    45  
   41    42    43    44    45    47  
   42    43    44  
   43    44    45    46    47    48    49    58  
   44    45    47  
   45    46    47    48    49    50    51    52    58  
   46    47    48    49    58  
   47  
   48    49    50    51    52    53    54    58    55  
   49    50    51    52    58  
   50    51    52    53    54    58    55    56    57    59  
   51    52    58    55  
   52    53    54    58    55    56    57    59    60    61    62  
   53    54    58    55    56    57    59  
   54    58    55  
   58    55  
   56    57    59    60    61    62    63    64    58  
   57    59    60    61    62  
   59    60    61    62  
    0  
   60    61    62    63    64    65    69  
   61    62    63    64  
   62    63    64  
   63    64    65    66    67    68    69    70    71    72  
   64    65    69  
   65    66    67    68    69    70    71    72  
   66    67    68    69    70    71    72  
   67    68    69  
   68    69  
   69  
   70    71    72  
   71    72  
   72  
    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  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   45   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5000   0.0660   0.308000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   52   3.5000   0.0660   0.209000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.120000   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   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   59   3.5000   0.0660  -0.120000   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   63   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   65   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   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    45   317.000  1.522
   38    39   340.000  1.080
   38    40   465.000  1.376
   40    41   745.000  1.250
   40    42   465.000  1.376
   42    43   340.000  1.080
   42    44   549.000  1.340
   44    45   320.000  1.462
   44    47   317.000  1.510
   45    46   570.000  1.229
   47    48   340.000  1.090
   47    49   317.000  1.510
   47    58   320.000  1.410
   49    50   340.000  1.080
   49    51   549.000  1.340
   51    52   317.000  1.510
   51    55   317.000  1.510
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    58   320.000  1.410
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    59   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   317.000  1.510
   62    63   340.000  1.080
   62    64   549.000  1.340
   64    65   317.000  1.510
   64    69   317.000  1.510
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   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    45    75.00000  110.18000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    45    44    65.00000  118.62400
   33    45    46    80.00000  120.40000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  137.10300
   38    40    42    70.00000  123.01800
   40    38    39    40.00000  120.50800
   40    42    43    40.00000  120.50800
   40    42    44    70.00000  117.34000
   42    40    41    65.00000  137.10300
   42    44    45    65.00000  118.96000
   42    44    47    70.00000  124.00000
   44    42    43    35.00000  120.00000
   44    45    46    80.00000  123.72100
   44    47    48    35.00000  109.50000
   44    47    49    70.00000  110.12100
   44    47    58    85.00000  110.90400
   45    33    34    35.00000  109.50000
   45    33    38    70.00000  109.06800
   47    44    45    65.00000  116.34900
   47    49    50    35.00000  117.00000
   47    49    51    70.00000  124.00000
   47    58    52    60.00000  109.50000
   49    47    48    35.00000  109.50000
   49    51    52    70.00000  124.00000
   49    51    55    70.00000  124.00000
   51    49    50    35.00000  120.00000
   51    52    53    35.00000  109.50000
   51    52    54    35.00000  109.50000
   51    52    58    85.00000  110.90400
   51    55    56    35.00000  109.50000
   51    55    57    35.00000  109.50000
   51    55    59    70.00000  112.02700
   54    52    53    33.00000  107.80000
   58    47    48    35.00000  109.50000
   58    47    49    85.00000  110.90400
   58    52    53    35.00000  109.50000
   58    52    54    35.00000  109.50000
   55    51    52    65.00000  117.92700
   55    59    60    37.50000  110.70000
   55    59    61    37.50000  110.70000
   55    59    62    70.00000  112.02700
   57    55    56    33.00000  107.80000
   59    55    56    37.50000  110.70000
   59    55    57    37.50000  110.70000
   59    62    63    35.00000  117.00000
   59    62    64    70.00000  124.00000
   61    59    60    33.00000  107.80000
   62    59    60    35.00000  109.50000
   62    59    61    35.00000  109.50000
   62    64    65    70.00000  124.00000
   62    64    69    70.00000  124.00000
   64    62    63    35.00000  120.00000
   64    65    66    35.00000  109.50000
   64    65    67    35.00000  109.50000
   64    65    68    35.00000  109.50000
   64    69    70    35.00000  109.50000
   64    69    71    35.00000  109.50000
   64    69    72    35.00000  109.50000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   69    64    65    65.00000  117.92700
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    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    45   0.01700  1.0 1.0
   24    29    33    45  -0.23550 -1.0 2.0
   24    29    33    45   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   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    45    44   0.65300  1.0 1.0
   29    33    45    44  -0.03850 -1.0 2.0
   29    33    45    44   0.33900  1.0 3.0
   29    33    45    46   0.30150 -1.0 2.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    42   7.00000 -1.0 2.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    45    44   0.00000  1.0 1.0
   34    33    45    46   0.00000  1.0 1.0
   38    33    45    44   0.65300  1.0 1.0
   38    33    45    44  -0.03850 -1.0 2.0
   38    33    45    44   0.33900  1.0 3.0
   38    33    45    46   0.30150 -1.0 2.0
   38    40    42    43   7.00000 -1.0 2.0
   38    40   -42    44   7.00000 -1.0 2.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42    44    45   7.00000 -1.0 2.0
   40    42    44    47   7.00000 -1.0 2.0
   41    40    42    43   7.00000 -1.0 2.0
   41    40    42    44   7.00000 -1.0 2.0
   42    44   -45    33  -0.33500  1.0 1.0
   42    44   -45    33   1.06600 -1.0 2.0
   42    44   -45    33  -0.14000  1.0 3.0
   42    44    45    46   1.00000 -1.0 2.0
   42    44    47    48   0.00000  1.0 1.0
   42    44    47    49  -0.28300  1.0 1.0
   42    44    47    49   0.26700 -1.0 2.0
   42    44    47    49  -0.63300  1.0 3.0
   42    44    47    58   0.39000  1.0 1.0
   42    44    47    58  -0.05800 -1.0 2.0
   42    44    47    58  -0.55150  1.0 3.0
   43    42    44    45   7.00000 -1.0 2.0
   43    42    44    47   7.00000 -1.0 2.0
   44    47    49    50   0.00000  1.0 1.0
   44    47    49    51  -0.28300  1.0 1.0
   44    47    49    51   0.26700 -1.0 2.0
   44    47    49    51  -0.63300  1.0 3.0
   44    47    58    52  -0.77900  1.0 1.0
   44    47    58    52  -0.36900 -1.0 2.0
   44    47    58    52   0.40400  1.0 3.0
   45    33    38    39   0.00000  1.0 1.0
   45    33   -38    40  -0.51250  1.0 1.0
   45    33   -38    40  -0.88800 -1.0 2.0
   45    33   -38    40   0.08850  1.0 3.0
   45    44    47    48   0.15000  1.0 3.0
   45    44    47    49   0.09700  1.0 1.0
   45    44    47    49   0.15600 -1.0 2.0
   45    44    47    49  -0.50800  1.0 3.0
   45    44    47    58   0.09700  1.0 1.0
   45    44    47    58   0.15600 -1.0 2.0
   45    44    47    58  -0.50800  1.0 3.0
   47    44    45    33   0.25700  1.0 1.0
   47    44    45    33   0.66200 -1.0 2.0
   47    44    45    33   0.04450  1.0 3.0
   47    44    45    46  -0.64400  1.0 1.0
   47    44    45    46   0.26850 -1.0 2.0
   47    49   -51    52   7.00000 -1.0 2.0
   47    49    51    55   7.00000 -1.0 2.0
   48    47    49    50   0.33100  1.0 3.0
   48    47    49    51   0.00000  1.0 1.0
   48    47    58    52   0.37050  1.0 3.0
   49    47   -58    52  -0.77900  1.0 1.0
   49    47   -58    52  -0.36900 -1.0 2.0
   49    47   -58    52   0.40400  1.0 3.0
   49    51    52    53   0.00000  1.0 1.0
   49    51    52    54   0.00000  1.0 1.0
   49    51   -52    58   0.39000  1.0 1.0
   49    51   -52    58  -0.05800 -1.0 2.0
   49    51   -52    58  -0.55150  1.0 3.0
   49    51    55    56   0.00000  1.0 1.0
   49    51    55    57   0.00000  1.0 1.0
   49    51    55    59   0.09850  1.0 1.0
   49    51    55    59   0.15250 -1.0 2.0
   49    51    55    59  -0.50650  1.0 3.0
   50    49    51    52   7.00000 -1.0 2.0
   50    49    51    55   7.00000 -1.0 2.0
   51    52   -58    47  -0.77900  1.0 1.0
   51    52   -58    47  -0.36900 -1.0 2.0
   51    52   -58    47   0.40400  1.0 3.0
   51    55    59    60   0.15000  1.0 3.0
   51    55    59    61   0.15000  1.0 3.0
   51    55    59    62   0.31000  1.0 1.0
   51    55    59    62   0.14700 -1.0 2.0
   51    55    59    62   0.07550  1.0 3.0
   52    51    55    56   0.34800  1.0 3.0
   52    51    55    57   0.34800  1.0 3.0
   52    51    55    59   0.46850  1.0 1.0
   52    51    55    59   0.08550 -1.0 2.0
   52    51    55    59   0.09800  1.0 3.0
   53    52    58    47   0.37050  1.0 3.0
   54    52    58    47   0.37050  1.0 3.0
   58    47    49    50   0.00000  1.0 1.0
   58    47   -49    51   0.39000  1.0 1.0
   58    47   -49    51  -0.05800 -1.0 2.0
   58    47   -49    51  -0.55150  1.0 3.0
   55    51    52    53   0.34800  1.0 3.0
   55    51    52    54   0.34800  1.0 3.0
   55    51    52    58   0.09700  1.0 1.0
   55    51    52    58   0.15600 -1.0 2.0
   55    51    52    58  -0.50800  1.0 3.0
   55    59    62    63   0.00000  1.0 1.0
   55    59    62    64   0.09850  1.0 1.0
   55    59    62    64   0.15250 -1.0 2.0
   55    59    62    64  -0.50650  1.0 3.0
   56    55    59    60   0.15000  1.0 3.0
   56    55    59    61   0.15000  1.0 3.0
   56    55    59    62   0.15000  1.0 3.0
   57    55    59    60   0.15000  1.0 3.0
   57    55    59    61   0.15000  1.0 3.0
   57    55    59    62   0.15000  1.0 3.0
   59    62    64    65   7.00000 -1.0 2.0
   59    62    64    69   7.00000 -1.0 2.0
   60    59    62    63   0.33100  1.0 3.0
   60    59    62    64   0.00000  1.0 1.0
   61    59    62    63   0.33100  1.0 3.0
   61    59    62    64   0.00000  1.0 1.0
   62    64    65    66   0.00000  1.0 1.0
   62    64    65    67   0.00000  1.0 1.0
   62    64    65    68   0.00000  1.0 1.0
   62    64    69    70   0.00000  1.0 1.0
   62    64    69    71   0.00000  1.0 1.0
   62    64    69    72   0.00000  1.0 1.0
   63    62    64    65   7.00000 -1.0 2.0
   63    62    64    69   7.00000 -1.0 2.0
   65    64    69    70   0.34800  1.0 3.0
   65    64    69    71   0.34800  1.0 3.0
   65    64    69    72   0.34800  1.0 3.0
   69    64    65    66   0.34800  1.0 3.0
   69    64    65    67   0.34800  1.0 3.0
   69    64    65    68   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    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   40    43    42    44   1.10000 -1.0 2.0
   45    47    44    42   1.10000 -1.0 2.0
   33    44    45    46  10.50000 -1.0 2.0
   47    50    49    51   1.10000 -1.0 2.0
   52    55    51    49   1.10000 -1.0 2.0
   59    63    62    64  15.00000 -1.0 2.0
   65    69    64    62  15.00000 -1.0 2.0
END
