* LIGAND DATABASE FILE (OPLS2005)
*
001      71    74    126    213     376
    1     0 S   NP   _N1_     1    28.73377    95.20038   -23.82395
    2     1 S   H    _HN1     2     1.02947    77.98852    11.32288
    3     1 S   H    _H1_     3     1.02824    30.98349   170.99285
    4     1 S   H    _H2_     4     1.02785   108.17619   -94.30790
    5     1 S   CT   _CA1     5     1.50129   132.74675   118.07185
    6     5 S   HC   _HA1     6     1.09572   105.17126    85.31877
    7     5 S   CO3  _C1_     7     1.53775   112.47055   -34.89102
    8     7 S   O2Z  _O11     8     1.26377   114.99704   -41.84854
    9     7 S   O2Z  _O12     9     1.26236   114.94698   137.19506
   10     5 S   CT   _CB1    10     1.53066   107.40217  -156.69538
   11    10 S   HC   HB11    11     1.09838   109.33885   -49.36316
   12    10 S   HC   HB12    12     1.09811   110.45877    67.23178
   13    10 S   CT   _CG1    13     1.53008   112.64857  -170.31655
   14    13 S   HC   HG11    14     1.09575   110.69449   -66.86080
   15    13 S   HC   HG12    15     1.09670   109.73720    52.39436
   16    13 S   C    _CD1    16     1.51807   112.07826   172.85677
   17    16 S   O    _OE1    17     1.22747   123.23539    10.30771
   18    16 S   N    _N2_    18     1.38652   111.78365  -169.79255
   19    18 S   H    _HN2    19     1.01585   118.95193     1.37174
   20    18 S   CT1  _CA2    20     1.46214   123.34737   176.98079
   21    20 S   HC   _HA2    21     1.09739   109.35775     4.98456
   22    20 S   C    _C2_    22     1.53591   108.65940  -110.51458
   23    22 S   O    _O2_    23     1.23054   122.22991  -147.91699
   24    20 S   CT   _CB2    32     1.53509   111.64415   127.01991
   25    24 S   HC   HB21    33     1.09433   109.39228    56.83906
   26    24 S   HC   HB22    34     1.09312   109.49517   175.90308
   27    22 S   N    _N3_    24     1.38321   113.78152    39.52156
   28    27 S   H    _HN3    25     1.01566   119.61745    -3.23707
   29    24 S   S    _SG2    35     1.82886   111.02747   -64.21467
   30    27 S   CT   _CA3    26     1.45288   123.23560   177.20873
   31    30 S   HC   HA31    27     1.09548   107.50544   -64.83101
   32    30 S   HC   HA32    28     1.09556   107.99760    51.61862
   33    29 S   CT   _C12    36     1.89839   102.58479   178.08204
   34    30 S   CO3  _C3_    29     1.52975   114.05738   173.61948
   35    34 S   O2Z  _O31    30     1.26380   116.06570    -0.63149
   36    34 S   O2Z  _O32    31     1.26426   114.41569   179.42973
   37    33 S   CM   _C14    37     1.55909   110.66733  -169.77149
   38    33 S   CO4  _C13    55     1.53459   101.47779    72.39839
   39    38 S   O    _O33    56     1.23212   121.35923    69.68173
   40    37 S   CM   _C19    38     1.36088   126.36551  -146.08982
   41    38 S   CA   _C8_    57     1.48782   119.66617  -107.53697
   42    40 S   CM   _C18    39     1.47211   123.31536   168.31956
   43    41 S   CA   _C9_    58     1.39089   120.94166    -5.93340
   44    42 S   CM   _C17    40     1.46310   118.15379    16.25053
   45    42 S   CMA  _C23    47     1.36239   118.78701  -162.63135
   46    45 S   OM   _O35    48     1.26426   131.91210  -179.63363
   47    43 S   CA   _C4_    59     1.41122   120.23807   178.69764
   48    47 S   HA   _H3_    60     1.09239   118.79611  -179.85329
   49    43 S   CO4  _C10    68     1.47141   122.00108    -1.38762
   50    49 S   O    _O40    69     1.22382   122.01762  -176.87889
   51    44 S   CM   _C16    41     1.33200   120.44630    -7.85138
   52    51 S   HC   _H5_    42     1.08449   121.36644   179.96574
   53    44 S   OH   _O37    45     1.38256   120.14721   172.38820
   54    53 S   HO   _H7_    46     0.97531   107.83695     2.37833
   55    45 S   CM   _C22    49     1.46817   118.67195     3.65522
   56    55 S   HC   _H6_    50     1.09344   116.95003   164.28289
   57    47 S   CA   _C5_    61     1.41077   123.53683    -0.02798
   58    57 S   OM   _O42    62     1.27649   122.83227  -179.58504
   59    33 S   CO4  _C11    70     1.50779   108.32353   -52.00194
   60    59 S   O    _O39    71     1.22618   124.86780   -71.51075
   61    37 S   CO4  _C15    43     1.52345   118.41987    38.32501
   62    61 S   O    _O38    44     1.22864   123.23278     8.42515
   63    55 S   CMA  _C21    51     1.34866   126.50169   -15.82721
   64    63 S   OM   _O36    52     1.26205   130.59285  -178.85414
   65    57 S   CA   _C6_    63     1.40759   114.29915     0.50629
   66    65 S   HA   _H4_    64     1.09173   118.93929   179.62051
   67    40 S   CO4  _C20    53     1.49991   120.66362   -16.02771
   68    67 S   O    _O34    54     1.22904   120.96982   -36.26814
   69    41 S   CA   _C7_    65     1.39922   121.17262   173.42836
   70    69 S   OH   _O41    66     1.37059   123.64669     1.24663
   71    70 S   HO   _H8_    67     0.97376   108.72670     6.90405
  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  10   5   4   3
  16   2   1   1  17  12   4  14  12  13  11  10   8   3   9   4
   5   2   5   3   2   1   5   3   5   3   2   1   2   1   3   2
   4   2   1   1   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    38    59    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    61    38    39    41    49    59    60  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    42    51    61    62    67    38    39    41    43    69    49    50    59    60  
   35    36  
   36  
    0  
   40    42    44    51    52    61    62    45    63    67    68    38    39    41    49    59    60  
   39    41    43    47    65    69    70    49    59    60    40    61  
   41    43    69    59  
   42    44    51    61    62    53    45    46    55    63    64    67    68    59  
   43    47    48    57    65    66    69    70    71    49    50    59  
   44    51    52    61    53    54    45    46    55    56    63    67    68  
   47    48    57    58    65    69    70    49    50    59    60  
   51    52    61    62    53    54    45    46    55    67  
   46    55    56    63    64    67    51    53  
   55    56    63  
   48    57    58    65    66    69    49    50    59  
   57    58    65    49  
   50    59    60    57    69  
   59    60  
   52    61    62    53    54  
   61    62    53  
   54    61  
    0  
   56    63    64    67    68  
   63    64    67  
   58    65    66    69    70  
   65    66    69  
   60    61  
    0  
   62    67  
    0  
   64    67    68  
   67    68  
   66    69    70    71  
   69    70  
   68  
    0  
   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   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   45   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   46   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   47   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   49   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   50   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5500   0.0760  -1.317400   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0700  -0.170000   2.5000   1.7750   0.001000000  -0.843144165
   58   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   59   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   61   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   63   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   64   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   68   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   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    38   317.000  1.522
   33    59   317.000  1.522
   37    40   549.000  1.340
   37    61   320.000  1.462
   40    42   380.000  1.444
   40    67   320.000  1.462
   42    44   380.000  1.444
   42    45   465.000  1.376
   44    51   549.000  1.340
   44    53   510.000  1.338
   51    52   340.000  1.080
   51    61   320.000  1.462
   61    62   570.000  1.229
   53    54   553.000  0.945
   45    46   745.000  1.250
   45    55   465.000  1.376
   55    56   340.000  1.080
   55    63   465.000  1.376
   63    64   745.000  1.250
   63    67   270.000  1.476
   67    68   570.000  1.229
   38    39   570.000  1.229
   38    41   310.000  1.470
   41    43   469.000  1.400
   41    69   469.000  1.400
   43    47   469.000  1.400
   43    49   310.000  1.470
   47    48   367.000  1.080
   47    57   469.000  1.400
   57    58   450.000  1.364
   57    65   469.000  1.400
   65    66   367.000  1.080
   65    69   469.000  1.400
   69    70   450.000  1.364
   70    71   553.000  0.945
   49    50   570.000  1.229
   49    59   250.000  1.523
   59    60   570.000  1.229
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    38    75.00000  110.18000
   29    33    59    75.00000  110.18000
   33    37    40    70.00000  124.00000
   33    37    61    65.00000  116.34900
   33    38    39    80.00000  120.40000
   33    38    41    65.00000  115.47100
   33    59    49    65.00000  115.45000
   33    59    60    80.00000  120.40000
   37    40    42    70.00000  123.01800
   37    40    67    65.00000  118.96000
   37    61    51    65.00000  118.65900
   37    61    62    80.00000  123.72100
   40    42    44    70.00000  123.01800
   40    42    45    70.00000  117.34000
   40    67    63    65.00000  118.65900
   40    67    68    80.00000  123.72100
   42    44    51    70.00000  123.01800
   42    44    53    80.00000  121.38400
   42    45    46    65.00000  137.10300
   42    45    55    70.00000  123.01800
   44    51    52    35.00000  120.00000
   44    51    61    65.00000  118.96000
   44    53    54    70.00000  107.45700
   51    61    62    80.00000  123.72100
   61    37    40    65.00000  118.96000
   61    51    52    40.00000  117.72500
   53    44    51    80.00000  121.38400
   45    42    44    70.00000  117.34000
   45    55    56    40.00000  120.50800
   45    55    63    70.00000  117.34000
   55    45    46    65.00000  137.10300
   55    63    64    65.00000  137.10300
   55    63    67    65.00000  114.61000
   63    55    56    40.00000  120.50800
   63    67    68    80.00000  120.81000
   67    40    42    65.00000  118.96000
   67    63    64    85.00000  116.28000
   38    33    37    70.00000  109.06800
   38    41    43    60.00000  119.52600
   38    41    69    60.00000  119.52600
   41    38    39    75.00000  123.78400
   41    43    47    63.00000  120.00000
   41    43    49    60.00000  119.52600
   41    69    65    63.00000  120.00000
   41    69    70    70.00000  120.00000
   43    47    48    35.00000  120.00000
   43    47    57    63.00000  120.00000
   43    49    50    75.00000  123.78400
   43    49    59    60.00000  117.28700
   47    57    58    70.00000  120.00000
   47    57    65    63.00000  120.00000
   57    47    48    35.00000  120.00000
   57    65    66    35.00000  120.00000
   57    65    69    63.00000  120.00000
   65    57    58    70.00000  120.00000
   65    69    70    70.00000  120.00000
   69    41    43    63.00000  120.00000
   69    65    66    35.00000  120.00000
   69    70    71    35.00000  113.00000
   49    43    47    60.00000  119.52600
   49    59    60    80.00000  119.30300
   59    33    37    70.00000  109.06800
   59    33    38    75.00000  107.99600
   59    49    50    80.00000  119.30300
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    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
   24    29    33    59   0.01700  1.0 1.0
   24    29    33    59  -0.23550 -1.0 2.0
   24    29    33    59   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    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    37    61   0.09700  1.0 1.0
   29    33    37    61   0.15600 -1.0 2.0
   29    33    37    61  -0.50800  1.0 3.0
   29    33    38    39   0.30150 -1.0 2.0
   29    33    38    41   0.65300  1.0 1.0
   29    33    38    41  -0.03850 -1.0 2.0
   29    33    38    41   0.33900  1.0 3.0
   29    33    59    49   0.65300  1.0 1.0
   29    33    59    49  -0.03850 -1.0 2.0
   29    33    59    49   0.33900  1.0 3.0
   29    33    59    60   0.30150 -1.0 2.0
   33    37    40    42   7.00000 -1.0 2.0
   33    37    40    67   7.00000 -1.0 2.0
   33    37    61    51   1.50000 -1.0 2.0
   33    37    61    62  -0.64400  1.0 1.0
   33    37    61    62   0.26850 -1.0 2.0
   33    38    41    43   2.26350  1.0 1.0
   33    38    41    43   0.76750 -1.0 2.0
   33    38    41    43   0.22500  1.0 3.0
   33    38    41    69   2.26350  1.0 1.0
   33    38    41    69   0.76750 -1.0 2.0
   33    38    41    69   0.22500  1.0 3.0
   37    33    38    39   0.30150 -1.0 2.0
   37    33    38    41   0.65300  1.0 1.0
   37    33    38    41  -0.03850 -1.0 2.0
   37    33    38    41   0.33900  1.0 3.0
   37    33    59    49   0.65300  1.0 1.0
   37    33    59    49  -0.03850 -1.0 2.0
   37    33    59    49   0.33900  1.0 3.0
   37    33    59    60   0.30150 -1.0 2.0
   37    40    42    44   0.28850  1.0 1.0
   37    40    42    44   2.61350 -1.0 2.0
   37    40    42    44   0.78400  1.0 3.0
   37    40    42    45   0.28850  1.0 1.0
   37    40    42    45   2.61350 -1.0 2.0
   37    40    42    45   0.78400  1.0 3.0
   37    40    67    63  -1.18350  1.0 1.0
   37    40    67    63   1.45950 -1.0 2.0
   37    40    67    68   1.00000 -1.0 2.0
   40    37    61    51  -1.18350  1.0 1.0
   40    37    61    51   1.45950 -1.0 2.0
   40    37    61    62   1.00000 -1.0 2.0
   40    42   -44    51   0.28850  1.0 1.0
   40    42   -44    51   2.61350 -1.0 2.0
   40    42   -44    51   0.78400  1.0 3.0
   40    42    44    53   0.50950  1.0 1.0
   40    42    44    53   0.56650 -1.0 2.0
   40    42    44    53   0.34050  1.0 3.0
   40    42    45    46   7.00000 -1.0 2.0
   40    42    45    55   7.00000 -1.0 2.0
   42    40    67    63  -1.18350  1.0 1.0
   42    40    67    63   1.45950 -1.0 2.0
   42    40    67    68   1.00000 -1.0 2.0
   42    44    51    52   7.00000 -1.0 2.0
   42    44    51    61   7.00000 -1.0 2.0
   42    44    53    54  -0.66100  1.0 1.0
   42    44    53    54   1.20850 -1.0 2.0
   42    44    53    54  -0.36000  1.0 3.0
   42    45    55    56   7.00000 -1.0 2.0
   42    45   -55    63   7.00000 -1.0 2.0
   44    42    45    46   7.00000 -1.0 2.0
   44    42    45    55   7.00000 -1.0 2.0
   44    51   -61    37  -1.18350  1.0 1.0
   44    51   -61    37   1.45950 -1.0 2.0
   44    51    61    62   1.00000 -1.0 2.0
   51    44    53    54  -0.66100  1.0 1.0
   51    44    53    54   1.20850 -1.0 2.0
   51    44    53    54  -0.36000  1.0 3.0
   52    51    61    37   0.93700 -1.0 2.0
   52    51    61    62   0.00000  1.0 1.0
   61    37   -40    42   7.00000 -1.0 2.0
   61    37    40    67   7.00000 -1.0 2.0
   53    44    51    52   7.00000 -1.0 2.0
   53    44    51    61   7.00000 -1.0 2.0
   45    42    44    51   0.28850  1.0 1.0
   45    42    44    51   2.61350 -1.0 2.0
   45    42    44    51   0.78400  1.0 3.0
   45    42    44    53   0.50950  1.0 1.0
   45    42    44    53   0.56650 -1.0 2.0
   45    42    44    53   0.34050  1.0 3.0
   45    55    63    64   7.00000 -1.0 2.0
   45    55    63    67   7.00000 -1.0 2.0
   46    45    55    56   7.00000 -1.0 2.0
   46    45    55    63   7.00000 -1.0 2.0
   55    63   -67    40  -1.18350  1.0 1.0
   55    63   -67    40   1.45950 -1.0 2.0
   55    63    67    68   1.00000 -1.0 2.0
   56    55    63    64   7.00000 -1.0 2.0
   56    55    63    67   7.00000 -1.0 2.0
   64    63    67    40   1.50000 -1.0 2.0
   64    63    67    68  -0.11900  1.0 1.0
   64    63    67    68   0.76850 -1.0 2.0
   64    63    67    68   0.14100  1.0 3.0
   67    40    42    44  -0.18600  1.0 3.0
   67    40   -42    45  -0.18600  1.0 3.0
   38    33    37    40  -0.51250  1.0 1.0
   38    33    37    40  -0.88800 -1.0 2.0
   38    33    37    40   0.08850  1.0 3.0
   38    33    37    61   0.09700  1.0 1.0
   38    33    37    61   0.15600 -1.0 2.0
   38    33    37    61  -0.50800  1.0 3.0
   38    33    59    49   0.65300  1.0 1.0
   38    33    59    49  -0.03850 -1.0 2.0
   38    33    59    49   0.33900  1.0 3.0
   38    33    59    60   0.30150 -1.0 2.0
   38    41    43    47   3.62500 -1.0 2.0
   38    41   -43    49   3.62500 -1.0 2.0
   38    41    69    65   3.62500 -1.0 2.0
   38    41    69    70   3.62500 -1.0 2.0
   39    38    41    43   1.05000 -1.0 2.0
   39    38    41    69   1.05000 -1.0 2.0
   41    43    47    48   3.62500 -1.0 2.0
   41    43    47    57   3.62500 -1.0 2.0
   41    43    49    50   1.05000 -1.0 2.0
   41    43    49    59   0.56600 -1.0 2.0
   41    69    70    71   0.84100 -1.0 2.0
   43    41    69    65   3.62500 -1.0 2.0
   43    41    69    70   3.62500 -1.0 2.0
   43    47    57    58   3.62500 -1.0 2.0
   43    47   -57    65   3.62500 -1.0 2.0
   43    49   -59    33   0.43900  1.0 1.0
   43    49   -59    33  -0.18150 -1.0 2.0
   43    49   -59    33  -0.03650  1.0 3.0
   43    49    59    60   0.03000  1.0 1.0
   43    49    59    60   0.58800 -1.0 2.0
   43    49    59    60   0.15550  1.0 3.0
   47    43    49    50   1.05000 -1.0 2.0
   47    43    49    59   0.56600 -1.0 2.0
   47    57    65    66   3.62500 -1.0 2.0
   47    57    65    69   3.62500 -1.0 2.0
   48    47    57    58   3.62500 -1.0 2.0
   48    47    57    65   3.62500 -1.0 2.0
   57    65   -69    41   3.62500 -1.0 2.0
   57    65    69    70   3.62500 -1.0 2.0
   58    57    65    66   3.62500 -1.0 2.0
   58    57    65    69   3.62500 -1.0 2.0
   65    69    70    71   0.84100 -1.0 2.0
   66    65    69    41   3.62500 -1.0 2.0
   66    65    69    70   3.62500 -1.0 2.0
   69    41   -43    47   3.62500 -1.0 2.0
   69    41    43    49   3.62500 -1.0 2.0
   49    43    47    48   3.62500 -1.0 2.0
   49    43    47    57   3.62500 -1.0 2.0
   50    49    59    33   0.49600 -1.0 2.0
   50    49    59    60   0.06100 -1.0 2.0
   59    33    37    40  -0.51250  1.0 1.0
   59    33    37    40  -0.88800 -1.0 2.0
   59    33    37    40   0.08850  1.0 3.0
   59    33    37    61   0.09700  1.0 1.0
   59    33    37    61   0.15600 -1.0 2.0
   59    33    37    61  -0.50800  1.0 3.0
   59    33    38    39   0.30150 -1.0 2.0
   59    33   -38    41   0.65300  1.0 1.0
   59    33   -38    41  -0.03850 -1.0 2.0
   59    33   -38    41   0.33900  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    61    37    40   1.10000 -1.0 2.0
   42    67    40    37   1.10000 -1.0 2.0
   40    44    42    45   1.10000 -1.0 2.0
   42    53    44    51   1.10000 -1.0 2.0
   61    52    51    44   1.10000 -1.0 2.0
   37    51    61    62  10.50000 -1.0 2.0
   55    46    45    42   1.10000 -1.0 2.0
   45    56    55    63   1.10000 -1.0 2.0
   67    64    63    55   1.10000 -1.0 2.0
   40    63    67    68  10.50000 -1.0 2.0
   33    41    38    39  10.50000 -1.0 2.0
   43    69    41    38   4.00000 -1.0 2.0
   47    49    43    41   4.00000 -1.0 2.0
   57    48    47    43   1.10000 -1.0 2.0
   65    58    57    47   4.00000 -1.0 2.0
   69    66    65    57   1.10000 -1.0 2.0
   65    70    69    41   4.00000 -1.0 2.0
   43    59    49    50  10.50000 -1.0 2.0
   33    49    59    60  10.50000 -1.0 2.0
END
