* LIGAND DATABASE FILE (OPLS2005)
*
001      70    71    125    195     368
    1     0 S   NP   _N1_     1    29.36798    99.23861   -22.18587
    2     1 S   H    _HN1     2     1.02801   105.13549   -97.75533
    3     1 S   H    _H1_     3     1.02945    52.06991     3.95116
    4     1 S   H    _H2_     4     1.02822    58.50404   160.26776
    5     1 S   CT   _CA1     5     1.50134   142.61625    77.01030
    6     5 S   HC   _HA1     6     1.09577   105.15408   124.18398
    7     5 S   CO3  _C1_     7     1.53769   112.37704     3.99508
    8     7 S   O2Z  _O11     8     1.26386   114.99087   -45.08920
    9     7 S   O2Z  _O12     9     1.26218   114.90898   133.69836
   10     5 S   CT   _CB1    10     1.53018   107.36401  -117.92723
   11    10 S   HC   HB11    11     1.09848   109.37096   -49.75393
   12    10 S   HC   HB12    12     1.09809   110.48654    66.84798
   13    10 S   CT   _CG1    13     1.52997   112.57698  -170.66453
   14    13 S   HC   HG11    14     1.09527   110.62456   -68.44337
   15    13 S   HC   HG12    15     1.09645   109.72026    50.79796
   16    13 S   C    _CD1    16     1.51771   111.64239   171.70369
   17    16 S   O    _OE1    17     1.22799   122.95745    20.56817
   18    16 S   N    _N2_    18     1.38563   112.15979  -159.80976
   19    18 S   H    _HN2    19     1.01706   119.01616     0.09691
   20    18 S   CT1  _CA2    20     1.46300   123.40609   177.81824
   21    20 S   HC   _HA2    21     1.09733   109.15897    11.15920
   22    20 S   C    _C2_    22     1.53664   109.38190  -104.69258
   23    22 S   O    _O2_    23     1.23112   122.08804  -150.33627
   24    20 S   CT   _CB2    32     1.53347   111.33791   132.91159
   25    24 S   HC   HB21    33     1.09348   109.33908    60.74262
   26    24 S   HC   HB22    34     1.09515   110.55443   178.81568
   27    22 S   N    _N3_    24     1.38275   114.06472    37.23312
   28    27 S   H    _HN3    25     1.01519   119.64798    -3.53419
   29    24 S   S    _SG2    35     1.82961   111.04363   -61.91689
   30    27 S   CT   _CA3    26     1.45273   123.28365   177.18401
   31    30 S   HC   HA31    27     1.09549   107.55703   -63.64123
   32    30 S   HC   HA32    28     1.09557   107.93725    52.79720
   33    29 S   CT   _C16    36     1.88569   101.22537   145.86036
   34    30 S   CO3  _C3_    29     1.52981   114.07215   174.78286
   35    34 S   O2Z  _O31    30     1.26386   116.11840     0.21489
   36    34 S   O2Z  _O32    31     1.26435   114.40735  -179.76761
   37    33 S   CM   _C11    37     1.54542   107.86744   -63.95171
   38    33 S   CT   _C19    60     1.55236   108.18817    65.00390
   39    38 S   HC   _H34    61     1.09481   112.07368   -59.74121
   40    38 S   HC   _H35    62     1.09517   109.83079  -177.85753
   41    37 S   CO4  _C10    38     1.51922   112.54422   -57.30390
   42    41 S   O    _O19    39     1.22672   122.67363   132.78674
   43    37 S   CMA  _C12    54     1.36611   133.01633   123.77911
   44    43 S   OM   _O17    55     1.26632   130.13262   176.16523
   45    38 S   CO4  _C13    63     1.52915   116.41828    62.09597
   46    45 S   O    _O20    64     1.23095   121.21369   -77.60501
   47    41 S   CA   _C7_    40     1.48273   117.03988   -44.06888
   48    43 S   CT   _C17    56     1.51923   121.65848    -3.26285
   49    48 S   HC   _H29    57     1.09470   110.92651    68.78447
   50    48 S   HC   _H30    58     1.09329   111.21916   -54.81989
   51    48 S   HC   _H31    59     1.10052   113.58011  -172.43885
   52    45 S   CT   _C18    65     1.51511   116.62162   105.24201
   53    52 S   HC   _H32    66     1.09451   109.78829   -38.73699
   54    52 S   HC   _H33    67     1.09503   108.25387    79.02988
   55    47 S   CA   _C8_    41     1.40152   119.27902    13.18425
   56    52 S   CO3  _C14    68     1.52151   111.22362  -158.80376
   57    56 S   O2Z  _O18    69     1.26288   115.16399  -102.89061
   58    56 S   O2Z  _O21    70     1.26366   115.00216    78.37121
   59    55 S   CA   _C5_    42     1.40469   119.32176  -179.16961
   60    59 S   HA   _H25    43     1.08787   120.16168   179.19741
   61    33 S   CT   _C15    51     1.55494   107.99342  -178.39880
   62    61 S   HC   _H27    52     1.09790   110.01857   -53.80991
   63    61 S   HC   _H28    53     1.09939   108.99552  -170.72142
   64    59 S   CA   _C4_    44     1.39364   120.75647    -1.14432
   65    64 S   HA   _H24    45     1.08605   120.05167  -179.65338
   66    64 S   CA   _C6_    46     1.39111   119.86541     0.28667
   67    66 S   HA   _H26    47     1.08669   119.75324  -179.89165
   68    47 S   CA   _C9_    48     1.40373   121.21860  -167.43886
   69    68 S   OH   _O22    49     1.36861   123.49067     0.29871
   70    69 S   HO   _H36    50     0.97415   109.11603    -3.78734
  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  12   5   4   3
  18   2   1   1  18  14   5   4  11   4   7   4   8   4  12   3
   2   1   1   5   4   3  10   2   1   1   9   4   4   1   1   5
   3   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    61    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    55    61    62    63    43    38    39    40    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    47    55    59    61    62    63    43    44    48    38    39    40    45    46    52  
   35    36  
   36  
    0  
   41    42    47    55    68    61    62    63    43    44    48    49    50    51    38    39    40    45  
   39    40    45    46    52    53    54    56    41    43    55    61    62    63  
   40    45    46    52    61  
   45    46    52    61  
   42    47    55    59    66    68    69    61    43    44    48  
   47    55    68    43  
   44    48    49    50    51    47    61  
   48    49    50    51  
   46    52    53    54    56    57    58    61  
   52    53    54    56  
   55    59    60    64    66    67    68    69    70    61    62    63  
   49    50    51  
   50    51  
   51  
    0  
   53    54    56    57    58  
   54    56    57    58  
   56    57    58  
   59    60    64    65    66    68    69    61    62    63  
   57    58  
   58  
    0  
   60    64    65    66    67    68    61    62    63  
   64    65    66    61  
   62    63    64    68  
   63  
    0  
   65    66    67    68    69  
   66    67    68  
   67    68    69    70  
   68    69  
   69    70  
   70  
    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  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   58   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   68   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   69   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   70   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    61   268.000  1.529
   33    38   268.000  1.529
   37    41   320.000  1.462
   37    43   465.000  1.376
   41    42   570.000  1.229
   41    47   310.000  1.470
   47    55   469.000  1.400
   47    68   469.000  1.400
   55    59   469.000  1.400
   55    61   317.000  1.510
   59    60   367.000  1.080
   59    64   469.000  1.400
   64    65   367.000  1.080
   64    66   469.000  1.400
   66    67   367.000  1.080
   66    68   469.000  1.400
   68    69   450.000  1.364
   69    70   553.000  0.945
   61    62   340.000  1.090
   61    63   340.000  1.090
   43    44   745.000  1.250
   43    48   270.000  1.512
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   340.000  1.090
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    45   317.000  1.522
   45    46   570.000  1.229
   45    52   317.000  1.522
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    56   317.000  1.522
   56    57   656.000  1.250
   56    58   656.000  1.250
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    61    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    37    41    65.00000  116.34900
   33    37    43    70.00000  124.00000
   33    61    55    70.00000  112.17500
   33    61    62    37.50000  110.70000
   33    61    63    37.50000  110.70000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    45    63.00000  111.10000
   37    41    42    80.00000  123.72100
   37    41    47    65.00000  117.02400
   37    43    44    65.00000  137.10300
   37    43    48    65.00000  122.18000
   41    47    55    60.00000  119.52600
   41    47    68    60.00000  119.52600
   47    41    42    75.00000  123.78400
   47    55    59    63.00000  120.00000
   47    55    61    70.00000  120.00000
   47    68    66    63.00000  120.00000
   47    68    69    70.00000  120.00000
   55    59    60    35.00000  120.00000
   55    59    64    63.00000  120.00000
   55    61    62    35.00000  109.50000
   55    61    63    35.00000  109.50000
   59    64    65    35.00000  120.00000
   59    64    66    63.00000  120.00000
   64    59    60    35.00000  120.00000
   64    66    67    35.00000  120.00000
   64    66    68    63.00000  120.00000
   66    64    65    35.00000  120.00000
   66    68    69    70.00000  120.00000
   68    47    55    63.00000  120.00000
   68    66    67    35.00000  120.00000
   68    69    70    35.00000  113.00000
   61    33    37    70.00000  112.02700
   61    55    59    70.00000  120.00000
   63    61    62    33.00000  107.80000
   43    37    41    60.00000  125.92000
   43    48    49    45.00000  110.52000
   43    48    50    45.00000  110.52000
   43    48    51    45.00000  110.52000
   48    43    44    85.00000  112.85300
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    61    58.35000  112.70000
   38    45    46    80.00000  120.40000
   38    45    52    70.00000  116.00000
   40    38    39    33.00000  107.80000
   45    38    39    35.00000  109.50000
   45    38    40    35.00000  109.50000
   45    52    53    35.00000  109.50000
   45    52    54    35.00000  109.50000
   45    52    56    70.00000  107.85200
   52    45    46    80.00000  120.40000
   52    56    57    70.00000  117.00000
   52    56    58    70.00000  117.00000
   54    52    53    33.00000  107.80000
   56    52    53    35.00000  109.50000
   56    52    54    35.00000  109.50000
   58    56    57    80.00000  126.00000
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    61   0.01700  1.0 1.0
   24    29    33    61  -0.23550 -1.0 2.0
   24    29    33    61   0.21350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   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    41   0.09700  1.0 1.0
   29    33    37    41   0.15600 -1.0 2.0
   29    33    37    41  -0.50800  1.0 3.0
   29    33    37    43   0.42700  1.0 1.0
   29    33    37    43  -0.70350 -1.0 2.0
   29    33    37    43  -0.43150  1.0 3.0
   29    33    61    55   0.56750  1.0 1.0
   29    33    61    55  -0.07550 -1.0 2.0
   29    33    61    55   0.20000  1.0 3.0
   29    33    61    62   0.15000  1.0 3.0
   29    33    61    63   0.15000  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    45   0.56750  1.0 1.0
   29    33    38    45  -0.07550 -1.0 2.0
   29    33    38    45   0.20000  1.0 3.0
   33    37    41    42  -0.64400  1.0 1.0
   33    37    41    42   0.26850 -1.0 2.0
   33    37    41    47   1.50000 -1.0 2.0
   33    37    43    44   7.00000 -1.0 2.0
   33    37    43    48   7.00000 -1.0 2.0
   33    38    45    46   0.30150 -1.0 2.0
   33    38    45    52   0.60050  1.0 1.0
   33    38    45    52   0.05600 -1.0 2.0
   33    38    45    52   0.26150  1.0 3.0
   37    33    61    55   0.21200  1.0 1.0
   37    33    61    55   0.16900 -1.0 2.0
   37    33    61    55  -1.15100  1.0 3.0
   37    33    61    62   0.15000  1.0 3.0
   37    33    61    63   0.15000  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  1.0 3.0
   37    33    38    45  -0.98800  1.0 1.0
   37    33    38    45   0.48800 -1.0 2.0
   37    33    38    45   0.76800  1.0 3.0
   37    41   -47    55  -0.11500  1.0 1.0
   37    41   -47    55   1.10450 -1.0 2.0
   37    41   -47    55  -0.48050  1.0 3.0
   37    41    47    68  -0.11500  1.0 1.0
   37    41    47    68   1.10450 -1.0 2.0
   37    41    47    68  -0.48050  1.0 3.0
   37    43    48    49   0.00000  1.0 1.0
   37    43    48    50   0.00000  1.0 1.0
   37    43    48    51   0.00000  1.0 1.0
   41    37    43    44   7.00000 -1.0 2.0
   41    37    43    48   7.00000 -1.0 2.0
   41    47    55    59   3.62500 -1.0 2.0
   41    47    55    61   3.62500 -1.0 2.0
   41    47    68    66   3.62500 -1.0 2.0
   41    47    68    69   3.62500 -1.0 2.0
   42    41    47    55   1.05000 -1.0 2.0
   42    41    47    68   1.05000 -1.0 2.0
   47    55    59    60   3.62500 -1.0 2.0
   47    55    59    64   3.62500 -1.0 2.0
   47    55   -61    33   0.04150 -1.0 2.0
   47    55    61    62   0.00000  1.0 1.0
   47    55    61    63   0.00000  1.0 1.0
   47    68    69    70   0.84100 -1.0 2.0
   55    47    68    66   3.62500 -1.0 2.0
   55    47    68    69   3.62500 -1.0 2.0
   55    59    64    65   3.62500 -1.0 2.0
   55    59   -64    66   3.62500 -1.0 2.0
   59    55    61    33   0.04150 -1.0 2.0
   59    55    61    62   0.00000  1.0 1.0
   59    55    61    63   0.00000  1.0 1.0
   59    64    66    67   3.62500 -1.0 2.0
   59    64    66    68   3.62500 -1.0 2.0
   60    59    64    65   3.62500 -1.0 2.0
   60    59    64    66   3.62500 -1.0 2.0
   64    66   -68    47   3.62500 -1.0 2.0
   64    66    68    69   3.62500 -1.0 2.0
   65    64    66    67   3.62500 -1.0 2.0
   65    64    66    68   3.62500 -1.0 2.0
   66    68    69    70   0.84100 -1.0 2.0
   67    66    68    47   3.62500 -1.0 2.0
   67    66    68    69   3.62500 -1.0 2.0
   68    47   -55    59   3.62500 -1.0 2.0
   68    47    55    61   3.62500 -1.0 2.0
   61    33   -37    41   0.09700  1.0 1.0
   61    33   -37    41   0.15600 -1.0 2.0
   61    33   -37    41  -0.50800  1.0 3.0
   61    33    37    43   0.09850  1.0 1.0
   61    33    37    43   0.15250 -1.0 2.0
   61    33    37    43  -0.50650  1.0 3.0
   61    33    38    39   0.15000  1.0 3.0
   61    33    38    40   0.15000  1.0 3.0
   61    33    38    45  -0.95700  1.0 1.0
   61    33    38    45  -0.18200 -1.0 2.0
   61    33    38    45   0.29450  1.0 3.0
   61    55    59    60   3.62500 -1.0 2.0
   61    55    59    64   3.62500 -1.0 2.0
   43    37    41    42   1.00000 -1.0 2.0
   43    37    41    47  -1.65800  1.0 1.0
   43    37    41    47   0.77650 -1.0 2.0
   44    43    48    49   0.00000  1.0 1.0
   44    43    48    50   0.00000  1.0 1.0
   44    43    48    51   0.00000  1.0 1.0
   38    33    37    41   0.09700  1.0 1.0
   38    33    37    41   0.15600 -1.0 2.0
   38    33    37    41  -0.50800  1.0 3.0
   38    33    37    43   0.09850  1.0 1.0
   38    33    37    43   0.15250 -1.0 2.0
   38    33    37    43  -0.50650  1.0 3.0
   38    33    61    55  -0.03700  1.0 1.0
   38    33    61    55   0.37200 -1.0 2.0
   38    33    61    55  -0.47300  1.0 3.0
   38    33    61    62   0.15000  1.0 3.0
   38    33    61    63   0.15000  1.0 3.0
   38    45    52    53   0.00000  1.0 1.0
   38    45    52    54   0.00000  1.0 1.0
   38    45    52    56   0.65300  1.0 1.0
   38    45    52    56  -0.03850 -1.0 2.0
   38    45    52    56   0.33900  1.0 3.0
   39    38    45    46   0.00000  1.0 1.0
   39    38    45    52   0.00000  1.0 1.0
   40    38    45    46   0.00000  1.0 1.0
   40    38    45    52   0.00000  1.0 1.0
   45    52    56    57   0.30150 -1.0 2.0
   45    52    56    58   0.30150 -1.0 2.0
   46    45    52    53   0.00000  1.0 1.0
   46    45    52    54   0.00000  1.0 1.0
   46    45    52    56   0.30150 -1.0 2.0
   53    52    56    57   0.00000  1.0 1.0
   53    52    56    58   0.00000  1.0 1.0
   54    52    56    57   0.00000  1.0 1.0
   54    52    56    58   0.00000  1.0 1.0
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    41    37    43   1.10000 -1.0 2.0
   37    47    41    42  10.50000 -1.0 2.0
   55    68    47    41   4.00000 -1.0 2.0
   59    61    55    47   4.00000 -1.0 2.0
   64    60    59    55   1.10000 -1.0 2.0
   66    65    64    59   1.10000 -1.0 2.0
   68    67    66    64   1.10000 -1.0 2.0
   66    69    68    47   4.00000 -1.0 2.0
   48    44    43    37   1.10000 -1.0 2.0
   38    52    45    46  10.50000 -1.0 2.0
   57    52    56    58  10.50000 -1.0 2.0
END
