* LIGAND DATABASE FILE (OPLS2005)
*
001      74    77    129    219     388
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02091   106.50012    -8.60505
    3     1 S   H    _H1_     3     1.02100    52.64488    92.63143
    4     1 S   H    _H2_     4     1.02075    59.51922  -110.93460
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08583   110.55165    58.73304
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C14    36     1.84333    97.44081  -178.17062
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CMA  _C15    37     1.53238   106.28274   -59.96673
   38    37 S   OM   _O35    38     1.23158   121.89431   -61.85732
   39    33 S   CM   _C12    56     1.50220   109.41841  -174.49430
   40    37 S   CM   _C16    39     1.48706   119.18000   118.26837
   41    39 S   CO4  _C13    57     1.49303   113.53472  -155.57065
   42    41 S   O    _O34    58     1.22637   120.27499    -0.13417
   43    40 S   CM   _C17    40     1.40484   120.79034     1.12030
   44    41 S   CA   _C8_    59     1.46538   118.26089   179.85329
   45    43 S   CM   _C18    41     1.40673   117.56066   177.73704
   46    45 S   HC   _H5_    42     1.08852   120.40036  -179.25849
   47    43 S   CM   _C22    50     1.47444   120.13707    -1.00347
   48    44 S   CA   _C9_    60     1.38864   120.12565     0.24945
   49    45 S   CM   _C19    43     1.39808   121.43425     1.29089
   50    33 S   CM   _C23    51     1.50412   108.41403    63.25821
   51    47 S   OH   _O39    54     1.38273   119.29818  -178.50695
   52    51 S   HO   _H9_    55     0.96302   109.84248    -0.05234
   53    48 S   CA   _C4_    61     1.40233   119.64108   180.00000
   54    53 S   HA   _H3_    62     1.08705   121.01934   179.92867
   55    48 S   CO4  _C10    71     1.47451   120.75433    -0.07402
   56    55 S   O    _O33    72     1.22941   118.46296   179.88986
   57    49 S   CM   _C20    44     1.38903   120.11155    -0.42336
   58    57 S   HC   _H6_    45     1.08964   118.58782   179.90309
   59    49 S   OH   _O37    48     1.36184   119.84855   179.56031
   60    59 S   HO   _H7_    49     0.97018   110.25047     0.02798
   61    50 S   OH   _O38    52     1.39023   114.82044    63.06591
   62    61 S   HO   _H8_    53     0.95868   109.27310  -179.96044
   63    53 S   CA   _C5_    63     1.39581   120.22832    -0.01978
   64    39 S   CMA  _C11    73     1.35315   122.74353    24.50160
   65    64 S   OM   _O40    74     1.26473   129.57267    -0.11191
   66    40 S   CO4  _C21    46     1.40472   118.23743  -179.79537
   67    66 S   O    _O36    47     1.28466   124.25250     1.70238
   68    63 S   CA   _C6_    64     1.39259   119.97982    -0.01978
   69    68 S   HA   _H4_    65     1.08689   119.87797  -179.96044
   70    63 S   OH   _O42    69     1.36051   119.96701  -180.00000
   71    70 S   HO   _H11    70     0.97047   110.31014    -0.05595
   72    44 S   CA   _C7_    66     1.40191   119.75619  -179.84174
   73    72 S   OH   _O41    67     1.36388   122.80950     0.03426
   74    73 S   HO   _H10    68     0.96926   110.15749     0.00000
  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
  17   2   1   1  13   5  13  11  11   4  12  12  10   4   7  11
   6   5   2   1  10   4   5   2   5   3   2   1   1   1   6   1
   1   1   1   6   3   2   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    50    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    47    50    61    39    41    64  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    43    66    47    50    61    62    51    39    41    42    44    55    64    65  
   35    36  
   36  
    0  
   38    40    43    45    57    66    67    47    50    61    39    41    64  
   40    43    66    50    39  
   41    42    44    48    72    55    56    64    65    40    47    50    61  
   43    45    46    49    57    58    66    67    47    50    51  
   42    44    48    53    68    72    73    55    64    65    50  
   44    48    72    64  
   45    46    49    57    66    67    59    47    50    61    51    52  
   48    53    54    63    68    69    72    73    74    55    56    64  
   46    49    57    58    66    59    60    47    50    51  
   49    57    59    47  
   50    61    62    51    52    49    66  
   53    54    63    68    72    73    70    55    56    64    65  
   57    58    66    67    59    60  
   61    62    51    52    64  
   52    61  
    0  
   54    63    68    69    72    70    71    55    56    64  
   63    68    70    55  
   56    64    65    63    72  
   64    65  
   58    66    67    59    60  
   66    67    59  
   60    66  
    0  
   62  
    0  
   68    69    72    73    70    71  
   65  
    0  
   67  
    0  
   69    72    73    74    70    71  
   72    73    70  
   71    72  
    0  
   73    74  
   74  
    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   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   38   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   39   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   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   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   44   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   45   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   48   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   50   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   51   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   57   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   61   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   63   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   64   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   65   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   66   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   67   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   68   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   69   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   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
   72   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   73   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   74   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   270.000  1.512
   33    50   317.000  1.510
   33    39   317.000  1.510
   37    38   745.000  1.250
   37    40   465.000  1.376
   40    43   380.000  1.444
   40    66   320.000  1.462
   43    45   549.000  1.340
   43    47   380.000  1.444
   45    46   340.000  1.080
   45    49   380.000  1.444
   49    57   549.000  1.340
   49    59   510.000  1.338
   57    58   340.000  1.080
   57    66   320.000  1.462
   66    67   570.000  1.229
   59    60   553.000  0.945
   47    50   549.000  1.340
   47    51   510.000  1.338
   50    61   510.000  1.338
   61    62   553.000  0.945
   51    52   553.000  0.945
   39    41   320.000  1.462
   39    64   465.000  1.376
   41    42   570.000  1.229
   41    44   310.000  1.470
   44    48   469.000  1.400
   44    72   469.000  1.400
   48    53   469.000  1.400
   48    55   310.000  1.470
   53    54   367.000  1.080
   53    63   469.000  1.400
   63    68   469.000  1.400
   63    70   450.000  1.364
   68    69   367.000  1.080
   68    72   469.000  1.400
   72    73   450.000  1.364
   73    74   553.000  0.945
   70    71   553.000  0.945
   55    56   570.000  1.229
   55    64   270.000  1.476
   64    65   745.000  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    50    75.00000  112.20000
   29    33    39    75.00000  112.20000
   33    37    38    85.00000  112.85300
   33    37    40    65.00000  122.18000
   33    50    47    70.00000  124.00000
   33    50    61    90.00000  109.34000
   33    39    41    65.00000  116.34900
   33    39    64    70.00000  124.00000
   37    40    43    70.00000  117.34000
   37    40    66    60.00000  125.92000
   40    37    38    65.00000  137.10300
   40    43    45    70.00000  123.01800
   40    43    47    70.00000  123.01800
   40    66    57    65.00000  118.65900
   40    66    67    80.00000  123.72100
   43    45    46    35.00000  120.00000
   43    45    49    70.00000  123.01800
   43    47    50    70.00000  123.01800
   43    47    51    80.00000  121.38400
   45    49    57    70.00000  123.01800
   45    49    59    80.00000  121.38400
   49    45    46    35.00000  120.00000
   49    57    58    35.00000  120.00000
   49    57    66    65.00000  118.96000
   49    59    60    70.00000  107.45700
   57    66    67    80.00000  123.72100
   66    40    43    65.00000  118.96000
   66    57    58    40.00000  117.72500
   59    49    57    80.00000  121.38400
   47    43    45    70.00000  123.01800
   47    50    61    80.00000  121.38400
   47    51    52    70.00000  107.45700
   50    33    37    70.00000  110.12100
   50    61    62    70.00000  107.45700
   51    47    50    80.00000  121.38400
   39    33    37    70.00000  110.12100
   39    33    50    70.00000  110.12100
   39    41    42    80.00000  123.72100
   39    41    44    65.00000  117.02400
   39    64    55    65.00000  114.61000
   39    64    65    65.00000  137.10300
   41    44    48    60.00000  119.52600
   41    44    72    60.00000  119.52600
   44    41    42    75.00000  123.78400
   44    48    53    63.00000  120.00000
   44    48    55    60.00000  119.52600
   44    72    68    63.00000  120.00000
   44    72    73    70.00000  120.00000
   48    53    54    35.00000  120.00000
   48    53    63    63.00000  120.00000
   48    55    56    75.00000  123.78400
   48    55    64    60.00000  117.44000
   53    63    68    63.00000  120.00000
   53    63    70    70.00000  120.00000
   63    53    54    35.00000  120.00000
   63    68    69    35.00000  120.00000
   63    68    72    63.00000  120.00000
   63    70    71    35.00000  113.00000
   68    72    73    70.00000  120.00000
   72    44    48    63.00000  120.00000
   72    68    69    35.00000  120.00000
   72    73    74    35.00000  113.00000
   70    63    68    70.00000  120.00000
   55    48    53    60.00000  119.52600
   55    64    65    85.00000  116.28000
   64    39    41    60.00000  125.92000
   64    55    56    80.00000  120.81000
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    50  -0.62250  1.0 1.0
   24    29    33    50  -0.38450 -1.0 2.0
   24    29    33    50   0.81900  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.09700  1.0 1.0
   29    33    37    38   0.15600 -1.0 2.0
   29    33    37    38  -0.50800  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    50    47   0.42700  1.0 1.0
   29    33    50    47  -0.70350 -1.0 2.0
   29    33    50    47  -0.43150  1.0 3.0
   29    33    50    61   0.09700  1.0 1.0
   29    33    50    61   0.15600 -1.0 2.0
   29    33    50    61  -0.50800  1.0 3.0
   29    33    39    41   0.09700  1.0 1.0
   29    33    39    41   0.15600 -1.0 2.0
   29    33    39    41  -0.50800  1.0 3.0
   29    33    39    64   0.42700  1.0 1.0
   29    33    39    64  -0.70350 -1.0 2.0
   29    33    39    64  -0.43150  1.0 3.0
   33    37    40    43   7.00000 -1.0 2.0
   33    37    40    66   7.00000 -1.0 2.0
   33    50    61    62   2.00000 -1.0 2.0
   33    39    41    42  -0.64400  1.0 1.0
   33    39    41    42   0.26850 -1.0 2.0
   33    39    41    44   1.50000 -1.0 2.0
   33    39    64    55   7.00000 -1.0 2.0
   33    39    64    65   7.00000 -1.0 2.0
   37    33    50    47  -0.28300  1.0 1.0
   37    33    50    47   0.26700 -1.0 2.0
   37    33    50    47  -0.63300  1.0 3.0
   37    33    50    61   0.09700  1.0 1.0
   37    33    50    61   0.15600 -1.0 2.0
   37    33    50    61  -0.50800  1.0 3.0
   37    33    39    41   0.09700  1.0 1.0
   37    33    39    41   0.15600 -1.0 2.0
   37    33    39    41  -0.50800  1.0 3.0
   37    33    39    64  -0.28300  1.0 1.0
   37    33    39    64   0.26700 -1.0 2.0
   37    33    39    64  -0.63300  1.0 3.0
   37    40    43    45   0.28850  1.0 1.0
   37    40    43    45   2.61350 -1.0 2.0
   37    40    43    45   0.78400  1.0 3.0
   37    40   -43    47   0.28850  1.0 1.0
   37    40   -43    47   2.61350 -1.0 2.0
   37    40   -43    47   0.78400  1.0 3.0
   37    40    66    57  -1.18350  1.0 1.0
   37    40    66    57   1.45950 -1.0 2.0
   37    40    66    67   1.00000 -1.0 2.0
   38    37    40    43   7.00000 -1.0 2.0
   38    37    40    66   7.00000 -1.0 2.0
   40    43    45    46   7.00000 -1.0 2.0
   40    43    45    49   7.00000 -1.0 2.0
   40    43    47    50   0.28850  1.0 1.0
   40    43    47    50   2.61350 -1.0 2.0
   40    43    47    50   0.78400  1.0 3.0
   40    43    47    51   0.50950  1.0 1.0
   40    43    47    51   0.56650 -1.0 2.0
   40    43    47    51   0.34050  1.0 3.0
   43    40    66    57  -1.18350  1.0 1.0
   43    40    66    57   1.45950 -1.0 2.0
   43    40    66    67   1.00000 -1.0 2.0
   43    45   -49    57   0.28850  1.0 1.0
   43    45   -49    57   2.61350 -1.0 2.0
   43    45   -49    57   0.78400  1.0 3.0
   43    45    49    59   0.50950  1.0 1.0
   43    45    49    59   0.56650 -1.0 2.0
   43    45    49    59   0.34050  1.0 3.0
   43    47   -50    33   7.00000 -1.0 2.0
   43    47    50    61   7.00000 -1.0 2.0
   43    47    51    52  -0.66100  1.0 1.0
   43    47    51    52   1.20850 -1.0 2.0
   43    47    51    52  -0.36000  1.0 3.0
   45    43    47    50   0.28850  1.0 1.0
   45    43    47    50   2.61350 -1.0 2.0
   45    43    47    50   0.78400  1.0 3.0
   45    43    47    51   0.50950  1.0 1.0
   45    43    47    51   0.56650 -1.0 2.0
   45    43    47    51   0.34050  1.0 3.0
   45    49    57    58   7.00000 -1.0 2.0
   45    49    57    66   7.00000 -1.0 2.0
   45    49    59    60  -0.66100  1.0 1.0
   45    49    59    60   1.20850 -1.0 2.0
   45    49    59    60  -0.36000  1.0 3.0
   46    45    49    57  -0.18600  1.0 3.0
   46    45    49    59   0.00000  1.0 1.0
   49    57   -66    40  -1.18350  1.0 1.0
   49    57   -66    40   1.45950 -1.0 2.0
   49    57    66    67   1.00000 -1.0 2.0
   57    49    59    60  -0.66100  1.0 1.0
   57    49    59    60   1.20850 -1.0 2.0
   57    49    59    60  -0.36000  1.0 3.0
   58    57    66    40   0.93700 -1.0 2.0
   58    57    66    67   0.00000  1.0 1.0
   66    40   -43    45  -0.18600  1.0 3.0
   66    40    43    47  -0.18600  1.0 3.0
   59    49    57    58   7.00000 -1.0 2.0
   59    49    57    66   7.00000 -1.0 2.0
   47    43    45    46   7.00000 -1.0 2.0
   47    43    45    49   7.00000 -1.0 2.0
   47    50    61    62  -0.66100  1.0 1.0
   47    50    61    62   1.20850 -1.0 2.0
   47    50    61    62  -0.36000  1.0 3.0
   50    33    37    38   0.09700  1.0 1.0
   50    33    37    38   0.15600 -1.0 2.0
   50    33    37    38  -0.50800  1.0 3.0
   50    33   -37    40  -0.28300  1.0 1.0
   50    33   -37    40   0.26700 -1.0 2.0
   50    33   -37    40  -0.63300  1.0 3.0
   50    33    39    41   0.09700  1.0 1.0
   50    33    39    41   0.15600 -1.0 2.0
   50    33    39    41  -0.50800  1.0 3.0
   50    33    39    64  -0.28300  1.0 1.0
   50    33    39    64   0.26700 -1.0 2.0
   50    33    39    64  -0.63300  1.0 3.0
   50    47    51    52  -0.66100  1.0 1.0
   50    47    51    52   1.20850 -1.0 2.0
   50    47    51    52  -0.36000  1.0 3.0
   51    47    50    33   7.00000 -1.0 2.0
   51    47    50    61   7.00000 -1.0 2.0
   39    33    37    38   0.09700  1.0 1.0
   39    33    37    38   0.15600 -1.0 2.0
   39    33    37    38  -0.50800  1.0 3.0
   39    33    37    40  -0.28300  1.0 1.0
   39    33    37    40   0.26700 -1.0 2.0
   39    33    37    40  -0.63300  1.0 3.0
   39    33    50    47  -0.28300  1.0 1.0
   39    33    50    47   0.26700 -1.0 2.0
   39    33    50    47  -0.63300  1.0 3.0
   39    33    50    61   0.09700  1.0 1.0
   39    33    50    61   0.15600 -1.0 2.0
   39    33    50    61  -0.50800  1.0 3.0
   39    41    44    48  -0.11500  1.0 1.0
   39    41    44    48   1.10450 -1.0 2.0
   39    41    44    48  -0.48050  1.0 3.0
   39    41    44    72  -0.11500  1.0 1.0
   39    41    44    72   1.10450 -1.0 2.0
   39    41    44    72  -0.48050  1.0 3.0
   41    39    64    55   7.00000 -1.0 2.0
   41    39    64    65   7.00000 -1.0 2.0
   41    44    48    53   3.62500 -1.0 2.0
   41    44   -48    55   3.62500 -1.0 2.0
   41    44    72    68   3.62500 -1.0 2.0
   41    44    72    73   3.62500 -1.0 2.0
   42    41    44    48   1.05000 -1.0 2.0
   42    41    44    72   1.05000 -1.0 2.0
   44    48    53    54   3.62500 -1.0 2.0
   44    48    53    63   3.62500 -1.0 2.0
   44    48    55    56   1.05000 -1.0 2.0
   44    48    55    64  -0.11500  1.0 1.0
   44    48    55    64   1.10450 -1.0 2.0
   44    48    55    64  -0.48050  1.0 3.0
   44    72    73    74   0.84100 -1.0 2.0
   48    44    72    68   3.62500 -1.0 2.0
   48    44    72    73   3.62500 -1.0 2.0
   48    53   -63    68   3.62500 -1.0 2.0
   48    53    63    70   3.62500 -1.0 2.0
   48    55   -64    39  -1.65800  1.0 1.0
   48    55   -64    39   0.77650 -1.0 2.0
   48    55    64    65   1.50000 -1.0 2.0
   53    48    55    56   1.05000 -1.0 2.0
   53    48    55    64  -0.11500  1.0 1.0
   53    48    55    64   1.10450 -1.0 2.0
   53    48    55    64  -0.48050  1.0 3.0
   53    63    68    69   3.62500 -1.0 2.0
   53    63    68    72   3.62500 -1.0 2.0
   53    63    70    71   0.84100 -1.0 2.0
   54    53    63    68   3.62500 -1.0 2.0
   54    53    63    70   3.62500 -1.0 2.0
   63    68   -72    44   3.62500 -1.0 2.0
   63    68    72    73   3.62500 -1.0 2.0
   68    63    70    71   0.84100 -1.0 2.0
   68    72    73    74   0.84100 -1.0 2.0
   69    68    72    44   3.62500 -1.0 2.0
   69    68    72    73   3.62500 -1.0 2.0
   72    44   -48    53   3.62500 -1.0 2.0
   72    44    48    55   3.62500 -1.0 2.0
   70    63    68    69   3.62500 -1.0 2.0
   70    63    68    72   3.62500 -1.0 2.0
   55    48    53    54   3.62500 -1.0 2.0
   55    48    53    63   3.62500 -1.0 2.0
   56    55    64    39   1.00000 -1.0 2.0
   56    55    64    65  -0.11900  1.0 1.0
   56    55    64    65   0.76850 -1.0 2.0
   56    55    64    65   0.14100  1.0 3.0
   64    39    41    42   1.00000 -1.0 2.0
   64    39   -41    44  -1.65800  1.0 1.0
   64    39   -41    44   0.77650 -1.0 2.0
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    38    37    40   1.10000 -1.0 2.0
   43    66    40    37   1.10000 -1.0 2.0
   40    47    43    45   1.10000 -1.0 2.0
   49    46    45    43   1.10000 -1.0 2.0
   45    59    49    57   1.10000 -1.0 2.0
   66    58    57    49   1.10000 -1.0 2.0
   40    57    66    67  10.50000 -1.0 2.0
   43    51    47    50   1.10000 -1.0 2.0
   33    61    50    47   1.10000 -1.0 2.0
   33    41    39    64   1.10000 -1.0 2.0
   39    44    41    42  10.50000 -1.0 2.0
   48    72    44    41   4.00000 -1.0 2.0
   53    55    48    44   4.00000 -1.0 2.0
   63    54    53    48   1.10000 -1.0 2.0
   68    70    63    53   4.00000 -1.0 2.0
   72    69    68    63   1.10000 -1.0 2.0
   68    73    72    44   4.00000 -1.0 2.0
   48    64    55    56  10.50000 -1.0 2.0
   55    65    64    39   1.10000 -1.0 2.0
END
