* LIGAND DATABASE FILE (OPLS2005)
*
001      73    74    130    202     384
    1     0 S   NP   _N1_     1    28.82714    95.91806   -20.99488
    2     1 S   H    _HN1     2     1.02782    90.08231   -87.89420
    3     1 S   H    _H1_     3     1.02952    79.44985    20.76216
    4     1 S   H    _H2_     4     1.02831    40.22863   153.84245
    5     1 S   CT   _CA1     5     1.50134   149.70599   133.38311
    6     5 S   HC   _HA1     6     1.09574   105.18877    73.27424
    7     5 S   CO3  _C1_     7     1.53733   112.30127   -46.89394
    8     7 S   O2Z  _O11     8     1.26372   115.01705   -44.76094
    9     7 S   O2Z  _O12     9     1.26223   114.93940   134.20982
   10     5 S   CT   _CB1    10     1.53066   107.39229  -168.83299
   11    10 S   HC   HB11    11     1.09831   109.28425   -49.83847
   12    10 S   HC   HB12    12     1.09817   110.48061    66.72971
   13    10 S   CT   _CG1    13     1.53007   112.69432  -170.85883
   14    13 S   HC   HG11    14     1.09492   110.51782   -65.71324
   15    13 S   HC   HG12    15     1.09662   109.90402    53.49902
   16    13 S   C    _CD1    16     1.51822   112.16418   173.78218
   17    16 S   O    _OE1    17     1.22746   123.22032     3.22513
   18    16 S   N    _N2_    18     1.38637   111.79785  -176.64211
   19    18 S   H    _HN2    19     1.01608   119.02187     0.36637
   20    18 S   CT1  _CA2    20     1.46292   123.25681   177.04885
   21    20 S   HC   _HA2    21     1.09740   109.34733    -5.71505
   22    20 S   C    _C2_    22     1.53431   108.43140  -121.08137
   23    22 S   O    _O2_    23     1.23034   122.34600  -148.22729
   24    20 S   CT   _CB2    32     1.53262   111.61173   116.39221
   25    24 S   HC   HB21    33     1.09393   109.87736    57.63582
   26    24 S   HC   HB22    34     1.09525   110.58762   175.64927
   27    22 S   N    _N3_    24     1.38358   113.52052    39.29580
   28    27 S   H    _HN3    25     1.01625   119.51604    -3.60435
   29    24 S   S    _SG2    35     1.82864   111.25891   -65.57876
   30    27 S   CT   _CA3    26     1.45282   123.16460   176.99743
   31    30 S   HC   HA31    27     1.09550   107.55075   -63.46982
   32    30 S   HC   HA32    28     1.09557   107.92747    52.94612
   33    29 S   CT   _C15    36     1.83790   100.37956   140.65037
   34    33 S   HC   _H3_    37     1.09495   107.46685    45.04436
   35    30 S   CO3  _C3_    29     1.52943   114.10888   174.92518
   36    35 S   O2Z  _O31    30     1.26372   116.05795    -0.19483
   37    35 S   O2Z  _O32    31     1.26429   114.41402   179.84934
   38    33 S   CO4  _C11    38     1.51329   108.60387   -72.74676
   39    38 S   O    _O18    39     1.22851   121.40272    96.59116
   40    38 S   CA   _C7_    40     1.48851   118.33006   -81.65325
   41    40 S   CA   _C6_    41     1.40511   120.04994   -11.32768
   42    41 S   CA   _C8_    42     1.40488   119.33708   177.42618
   43    41 S   CO4  _C10    52     1.48804   120.02767    -3.55963
   44    43 S   O    _O17    53     1.22818   120.52167   169.13088
   45    42 S   CA   _C4_    43     1.39411   120.71500     0.78385
   46    45 S   HA   _H23    44     1.08692   120.49201  -179.85873
   47    42 S   OH   _O19    50     1.36924   123.56154  -179.74056
   48    47 S   HO   _H37    51     0.97364   109.05320     3.56189
   49    33 S   CT   _C14    54     1.53588   111.10444   165.14246
   50    49 S   HC   _H26    55     1.09938   107.65781   -50.52870
   51    45 S   CA   _C5_    45     1.39052   119.92509     0.12972
   52    51 S   HA   _H24    46     1.08713   119.62060  -179.88986
   53    49 S   CT   _C19    56     1.54993   112.81894  -169.53484
   54    53 S   HC   _H36    57     1.09652   110.20612   -65.23115
   55    40 S   CA   _C9_    47     1.40476   120.58955   167.33802
   56    53 S   CT   _C18    58     1.53998   112.75332   172.36321
   57    56 S   HC   _H34    59     1.09566   110.42215    55.75064
   58    56 S   HC   _H35    60     1.09402   109.98688   -61.25115
   59    53 S   OH   _O21    72     1.43048   108.86756    51.79017
   60    59 S   HO   _H39    73     0.97272   108.00168    66.53361
   61    55 S   OH   _O20    48     1.36917   123.58518     1.45414
   62    61 S   HO   _H38    49     0.97337   109.09945     3.31228
   63    56 S   CM   _C12    61     1.50639   111.74691   174.46990
   64    63 S   HC   _H25    62     1.08971   113.95101   -71.88666
   65    63 S   CM   _C13    63     1.34673   128.03731   109.11333
   66    65 S   CT   _C16    64     1.50597   120.39272   178.64708
   67    66 S   HC   _H28    65     1.09496   110.27694   119.27226
   68    66 S   HC   _H29    66     1.09498   110.20626  -120.91201
   69    66 S   HC   _H30    67     1.09512   112.42856    -0.85569
   70    65 S   CT   _C17    68     1.50259   125.30599    -1.94350
   71    70 S   HC   _H31    69     1.09487   110.07783   114.94531
   72    70 S   HC   _H32    70     1.09186   113.62303    -6.11375
   73    70 S   HC   _H33    71     1.09543   110.02712  -125.78941
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  14   7   2   1   1  11   4  12  13  10  10   3   7   4   2   1
   9   4   4   2   9   6   2   9   5   4   2   1   1   1  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    49    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    49    50    53  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    55    43    44    49    50    53    54    56    59  
   38    39    40    43    49    50    53  
   36    37  
   37  
    0  
   39    40    41    42    51    55    61    43    49    50    53  
   40    41    55    49  
   41    42    45    51    52    55    61    62    47    43    44    49  
   42    45    46    51    55    61    47    48    43    44    49    50    53  
   45    46    51    52    55    47    48    43    44    49  
   44    49    50    53    54    56    59    45    47    55  
   49    50    53  
   46    51    52    55    61    47    48  
   51    52    55    47  
   48    51  
    0  
   50    53    54    56    57    58    63    59    60  
   53    54    56    59  
   52    55    61    62  
   55    61  
   54    56    57    58    63    64    65    59    60  
   56    57    58    63    59    60  
   61    62  
   57    58    63    64    65    66    70    59    60  
   58    63    64    65    59  
   63    64    65    59  
   60    63  
    0  
   62  
    0  
   64    65    66    67    68    69    70    71    72    73  
   65    66    70  
   66    67    68    69    70    71    72    73  
   67    68    69    70    71    72    73  
   68    69    70  
   69    70  
   70  
   71    72    73  
   72    73  
   73  
    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   3.7500   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   43   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   66   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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
   73   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  1.522
   33    49   268.000  1.529
   38    39   570.000  1.229
   38    40   310.000  1.470
   40    41   469.000  1.400
   40    55   469.000  1.400
   41    42   469.000  1.400
   41    43   310.000  1.470
   42    45   469.000  1.400
   42    47   450.000  1.364
   45    46   367.000  1.080
   45    51   469.000  1.400
   51    52   367.000  1.080
   51    55   469.000  1.400
   55    61   450.000  1.364
   61    62   553.000  0.945
   47    48   553.000  0.945
   43    44   570.000  1.229
   43    49   317.000  1.522
   49    50   340.000  1.090
   49    53   268.000  1.529
   53    54   340.000  1.090
   53    56   268.000  1.529
   53    59   320.000  1.410
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    63   317.000  1.510
   63    64   340.000  1.080
   63    65   549.000  1.340
   65    66   317.000  1.510
   65    70   317.000  1.510
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   59    60   553.000  0.945
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  110.18000
   29    33    49    75.00000  111.63000
   33    38    39    80.00000  120.40000
   33    38    40    65.00000  115.47100
   33    49    43    63.00000  111.10000
   33    49    50    37.50000  110.70000
   33    49    53    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    40    41    60.00000  119.52600
   38    40    55    60.00000  119.52600
   40    38    39    75.00000  123.78400
   40    41    42    63.00000  120.00000
   40    41    43    60.00000  119.52600
   40    55    51    63.00000  120.00000
   40    55    61    70.00000  120.00000
   41    42    45    63.00000  120.00000
   41    42    47    70.00000  120.00000
   41    43    44    75.00000  123.78400
   41    43    49    65.00000  115.47100
   42    45    46    35.00000  120.00000
   42    45    51    63.00000  120.00000
   42    47    48    35.00000  113.00000
   45    51    52    35.00000  120.00000
   45    51    55    63.00000  120.00000
   51    45    46    35.00000  120.00000
   51    55    61    70.00000  120.00000
   55    40    41    63.00000  120.00000
   55    51    52    35.00000  120.00000
   55    61    62    35.00000  113.00000
   47    42    45    70.00000  120.00000
   43    41    42    60.00000  119.52600
   43    49    50    35.00000  109.50000
   43    49    53    63.00000  111.10000
   49    33    34    37.50000  110.70000
   49    33    38    63.00000  111.10000
   49    43    44    80.00000  120.40000
   49    53    54    37.50000  110.70000
   49    53    56    58.35000  112.70000
   49    53    59    50.00000  109.50000
   53    49    50    37.50000  110.70000
   53    56    57    37.50000  110.70000
   53    56    58    37.50000  110.70000
   53    56    63    70.00000  112.02700
   53    59    60    55.00000  108.50000
   56    53    54    37.50000  110.70000
   56    63    64    35.00000  117.00000
   56    63    65    70.00000  124.00000
   58    56    57    33.00000  107.80000
   63    56    57    35.00000  109.50000
   63    56    58    35.00000  109.50000
   63    65    66    70.00000  124.00000
   63    65    70    70.00000  124.00000
   65    63    64    35.00000  120.00000
   65    66    67    35.00000  109.50000
   65    66    68    35.00000  109.50000
   65    66    69    35.00000  109.50000
   65    70    71    35.00000  109.50000
   65    70    72    35.00000  109.50000
   65    70    73    35.00000  109.50000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
   70    65    66    65.00000  117.92700
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   59    53    54    35.00000  109.50000
   59    53    56    50.00000  109.50000
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   0.01700  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    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   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   0.30150 -1.0 2.0
   29    33    38    40   0.65300  1.0 1.0
   29    33    38    40  -0.03850 -1.0 2.0
   29    33    38    40   0.33900  1.0 3.0
   29    33    49    43   0.56750  1.0 1.0
   29    33    49    43  -0.07550 -1.0 2.0
   29    33    49    43   0.20000  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    53   0.44750  1.0 1.0
   29    33    49    53  -0.17800 -1.0 2.0
   29    33    49    53   0.20200  1.0 3.0
   33    38    40    41   2.26350  1.0 1.0
   33    38    40    41   0.76750 -1.0 2.0
   33    38    40    41   0.22500  1.0 3.0
   33    38    40    55   2.26350  1.0 1.0
   33    38    40    55   0.76750 -1.0 2.0
   33    38    40    55   0.22500  1.0 3.0
   33    49    53    54   0.15000  1.0 3.0
   33    49    53    56   0.56750  1.0 1.0
   33    49    53    56  -0.07550 -1.0 2.0
   33    49    53    56   0.20000  1.0 3.0
   33    49    53    59   0.86500  1.0 1.0
   33    49    53    59  -0.17500 -1.0 2.0
   33    49    53    59   0.20800  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    49    43  -0.11250  1.0 3.0
   34    33    49    50   0.15000  1.0 3.0
   34    33    49    53   0.15000  1.0 3.0
   38    33    49    43   0.11950  1.0 1.0
   38    33    49    43   0.20300 -1.0 2.0
   38    33    49    43  -0.70800  1.0 3.0
   38    33    49    50  -0.11250  1.0 3.0
   38    33    49    53  -0.95700  1.0 1.0
   38    33    49    53  -0.18200 -1.0 2.0
   38    33    49    53   0.29450  1.0 3.0
   38    40    41    42   3.62500 -1.0 2.0
   38    40   -41    43   3.62500 -1.0 2.0
   38    40    55    51   3.62500 -1.0 2.0
   38    40    55    61   3.62500 -1.0 2.0
   39    38    40    41   1.05000 -1.0 2.0
   39    38    40    55   1.05000 -1.0 2.0
   40    41    42    45   3.62500 -1.0 2.0
   40    41    42    47   3.62500 -1.0 2.0
   40    41    43    44   1.05000 -1.0 2.0
   40    41    43    49   2.26350  1.0 1.0
   40    41    43    49   0.76750 -1.0 2.0
   40    41    43    49   0.22500  1.0 3.0
   40    55    61    62   0.84100 -1.0 2.0
   41    40    55    51   3.62500 -1.0 2.0
   41    40    55    61   3.62500 -1.0 2.0
   41    42    45    46   3.62500 -1.0 2.0
   41    42   -45    51   3.62500 -1.0 2.0
   41    42    47    48   0.84100 -1.0 2.0
   41    43   -49    33   0.05850 -1.0 2.0
   41    43   -49    33   0.17250  1.0 3.0
   41    43    49    50   0.00000  1.0 1.0
   41    43    49    53   0.05850 -1.0 2.0
   41    43    49    53   0.17250  1.0 3.0
   42    41    43    44   1.05000 -1.0 2.0
   42    41    43    49   2.26350  1.0 1.0
   42    41    43    49   0.76750 -1.0 2.0
   42    41    43    49   0.22500  1.0 3.0
   42    45    51    52   3.62500 -1.0 2.0
   42    45    51    55   3.62500 -1.0 2.0
   45    42    47    48   0.84100 -1.0 2.0
   45    51   -55    40   3.62500 -1.0 2.0
   45    51    55    61   3.62500 -1.0 2.0
   46    45    51    52   3.62500 -1.0 2.0
   46    45    51    55   3.62500 -1.0 2.0
   51    55    61    62   0.84100 -1.0 2.0
   52    51    55    40   3.62500 -1.0 2.0
   52    51    55    61   3.62500 -1.0 2.0
   55    40   -41    42   3.62500 -1.0 2.0
   55    40    41    43   3.62500 -1.0 2.0
   47    42    45    46   3.62500 -1.0 2.0
   47    42    45    51   3.62500 -1.0 2.0
   43    41    42    45   3.62500 -1.0 2.0
   43    41    42    47   3.62500 -1.0 2.0
   43    49    53    54  -0.11250  1.0 3.0
   43    49    53    56  -0.95700  1.0 1.0
   43    49    53    56  -0.18200 -1.0 2.0
   43    49    53    56   0.29450  1.0 3.0
   43    49    53    59  -0.09450  1.0 1.0
   43    49    53    59  -1.12950 -1.0 2.0
   43    49    53    59   0.54000  1.0 3.0
   44    43    49    33   0.30150 -1.0 2.0
   44    43    49    50   0.00000  1.0 1.0
   44    43    49    53   0.30150 -1.0 2.0
   49    33    38    39   0.30150 -1.0 2.0
   49    33   -38    40   0.05850 -1.0 2.0
   49    33   -38    40   0.17250  1.0 3.0
   49    53    56    57   0.15000  1.0 3.0
   49    53    56    58   0.15000  1.0 3.0
   49    53    56    63   0.34400  1.0 1.0
   49    53    56    63   0.09450 -1.0 2.0
   49    53    56    63   0.11100  1.0 3.0
   49    53    59    60  -0.11600  1.0 1.0
   49    53    59    60  -0.09450 -1.0 2.0
   49    53    59    60   0.21250  1.0 3.0
   50    49    53    54   0.15000  1.0 3.0
   50    49    53    56   0.15000  1.0 3.0
   50    49    53    59   0.23400  1.0 3.0
   53    56    63    64   0.00000  1.0 1.0
   53    56    63    65   0.09850  1.0 1.0
   53    56    63    65   0.15250 -1.0 2.0
   53    56    63    65  -0.50650  1.0 3.0
   54    53    56    57   0.15000  1.0 3.0
   54    53    56    58   0.15000  1.0 3.0
   54    53    56    63   0.15000  1.0 3.0
   54    53    59    60   0.19450  1.0 3.0
   56    53    59    60  -0.11600  1.0 1.0
   56    53    59    60  -0.09450 -1.0 2.0
   56    53    59    60   0.21250  1.0 3.0
   56    63    65    66   7.00000 -1.0 2.0
   56    63    65    70   7.00000 -1.0 2.0
   57    56    63    64   0.33100  1.0 3.0
   57    56    63    65   0.00000  1.0 1.0
   58    56    63    64   0.33100  1.0 3.0
   58    56    63    65   0.00000  1.0 1.0
   63    65    66    67   0.00000  1.0 1.0
   63    65    66    68   0.00000  1.0 1.0
   63    65    66    69   0.00000  1.0 1.0
   63    65    70    71   0.00000  1.0 1.0
   63    65    70    72   0.00000  1.0 1.0
   63    65    70    73   0.00000  1.0 1.0
   64    63    65    66   7.00000 -1.0 2.0
   64    63    65    70   7.00000 -1.0 2.0
   66    65    70    71   0.34800  1.0 3.0
   66    65    70    72   0.34800  1.0 3.0
   66    65    70    73   0.34800  1.0 3.0
   70    65    66    67   0.34800  1.0 3.0
   70    65    66    68   0.34800  1.0 3.0
   70    65    66    69   0.34800  1.0 3.0
   59    53    56    57   0.23400  1.0 3.0
   59    53    56    58   0.23400  1.0 3.0
   59    53    56    63   1.05650  1.0 1.0
   59    53    56    63   0.15600 -1.0 2.0
   59    53    56    63   0.53150  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    40    38    39  10.50000 -1.0 2.0
   41    55    40    38   4.00000 -1.0 2.0
   42    43    41    40   4.00000 -1.0 2.0
   45    47    42    41   4.00000 -1.0 2.0
   51    46    45    42   1.10000 -1.0 2.0
   55    52    51    45   1.10000 -1.0 2.0
   51    61    55    40   4.00000 -1.0 2.0
   41    49    43    44  10.50000 -1.0 2.0
   56    64    63    65  15.00000 -1.0 2.0
   66    70    65    63  15.00000 -1.0 2.0
END
