* LIGAND DATABASE FILE (OPLS2005)
*
001     106   112    218    375     665
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02124    87.87101   -72.52325
    3     1 S   H    _H1_     3     1.02067    92.60323    36.13167
    4     1 S   H    _H2_     4     1.02127    33.03601   157.39491
    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     1.08611   110.49349    58.84143
   26    24 S   HC   HB22    34     1.08575   109.90351   179.01802
   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   _C30    36     1.80803    98.58951  -178.15963
   34    33 S   HC   _H33    37     1.09376   109.20339   -59.23545
   35    33 S   HC   _H34    38     1.09296   109.38072    58.95542
   36    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   37    36 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   38    36 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   39    33 S   CM   _C28    39     1.48733   110.02180  -179.96574
   40    39 S   CM   _C29    40     1.33228   128.38337  -119.66988
   41    40 S   OS   _O36    41     1.38475   115.53568   178.89979
   42    40 S   OH   _O37   105     1.36866   124.18771    -1.77762
   43    42 S   HO   _H32   106     0.96601   110.54988  -179.96044
   44    41 S   CT   _C25    42     1.45210   104.36115   -10.29241
   45    44 S   HC   _H11    43     1.09954   106.06445  -101.06391
   46    44 S   CT   _C24    44     1.52842   107.09074   142.51644
   47    46 S   HC   _H28    45     1.09999   108.19685    51.03566
   48    46 S   HC   _H29    46     1.09847   109.51879   -60.85693
   49    39 S   CT   _C26    62     1.49375   122.55900    59.17977
   50    49 S   HC   _H12    63     1.09955   109.22707   -55.30371
   51    46 S   CT   _C23    47     1.53516   116.43054   174.22297
   52    51 S   HC   _H10    48     1.09037   105.76752   166.20158
   53    51 S   CT   _C22    49     1.54617   115.14322    43.61960
   54    53 S   HC   _H9_    50     1.09724   107.52919   -86.07870
   55    51 S   CT   _C31   101     1.53632   110.30234   -80.64449
   56    55 S   HC   _H35   102     1.08531   109.37946    66.37611
   57    55 S   HC   _H36   103     1.08561   109.38291   -53.64332
   58    55 S   HC   _H37   104     1.08588   109.31960  -173.59213
   59    53 S   CT   _C18    51     1.54339   114.97756   151.33820
   60    59 S   HC   _H8_    52     1.09325   115.27713    56.93719
   61    59 S   CT   _C19    53     1.53927   104.13243   -67.56169
   62    61 S   HC   _H26    54     1.09256   112.74559  -154.91506
   63    61 S   HC   _H27    55     1.09196   113.03498    79.74830
   64    61 S   CO4  _C20    56     1.51108    98.55777   -36.60038
   65    64 S   O    _O35    57     1.22202   124.21864  -177.85324
   66    53 S   CT   _C21    58     1.55138   119.26992    41.12597
   67    66 S   CT   _C27    59     1.53063   117.50696   -53.23805
   68    67 S   HC   _H30    60     1.09277   109.24063  -149.35530
   69    67 S   HC   _H31    61     1.09486   110.84099    96.08358
   70    66 S   CT   _C16    64     1.58889   102.53555   176.69500
   71    70 S   CO4  _C32    65     1.52538   111.66029    79.63204
   72    71 S   O    _O38    66     1.22308   126.48431   -69.42378
   73    59 S   CT   _C17    98     1.55192   102.26519   179.37317
   74    73 S   HC   _H24    99     1.08533   110.01812   158.05859
   75    73 S   HC   _H25   100     1.09420   109.92481   -83.33083
   76    71 S   OS   _O39    67     1.35236   111.40210   110.08352
   77    76 S   CT   _C7_    68     1.43019   112.36827     2.67078
   78    77 S   HC   _H4_    69     1.11580   105.95646  -108.03090
   79    77 S   CT   _C6_    70     1.53163   105.77148   137.06691
   80    79 S   HC   _H16    71     1.09833   108.83481    45.68287
   81    79 S   HC   _H17    72     1.09185   109.24360   -65.91467
   82    70 S   CT   _C8_    86     1.57290   113.92721  -164.85965
   83    82 S   HC   _H5_    87     1.04548   105.68818     5.64445
   84    79 S   CT   _C5_    73     1.53972   115.30758   168.30201
   85    84 S   HC   _H3_    74     1.09546   107.84772   161.54318
   86    84 S   CT   _C11    75     1.53265   110.78665    41.28875
   87    86 S   HC   _H7_    76     1.11055   107.47578   -68.23905
   88    84 S   CT   _C4_    94     1.53595   109.91040   -82.20304
   89    88 S   HC   _H13    95     1.08514   109.27894    63.14374
   90    88 S   HC   _H14    96     1.08543   109.27936   -56.84113
   91    88 S   HC   _H15    97     1.08566   109.27409  -176.82547
   92    86 S   CM   _C12    77     1.50430   117.53409   174.59079
   93    92 S   HC   _H18    78     1.07524   123.71169    36.43491
   94    92 S   CM   _C13    79     1.33401   113.54667  -149.85528
   95    94 S   HC   _H19    80     1.07455   128.79708  -173.78748
   96    94 S   CO4  _C14    81     1.47628   105.38242     6.30158
   97    96 S   O    _O33    82     1.22268   121.80403  -172.36439
   98    86 S   CT   _C10    83     1.55084   114.25998    52.54546
   99    98 S   CT   _C9_    84     1.56565   114.28774   -78.19712
  100    99 S   HC   _H6_    85     1.10002   106.75172   121.10179
  101    98 S   CT   _C15    90     1.55346   114.16644    47.69744
  102   101 S   HC   _H20    91     1.08389   109.00706   -74.73143
  103   101 S   HC   _H21    92     1.08312   109.08105   165.26373
  104   101 S   HC   _H22    93     1.08320   108.99353    45.18766
  105    99 S   OH   _O34    88     1.42860   107.84329  -125.58562
  106   105 S   HO   _H23    89     0.96355   105.10371   -51.44943
  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   6   5   4   3
  10   4   3   2   1   1  13   9  11   3   1  14   7  15   6   5
   9   4  15   8  22   9   5   2   1   1  14   9  10   5   4   9
   3  14   6   2   1  15  11   4   7   2   1   9  14   7  15   6
   5  10   4  14   8  19   8   5   2   1   1   8   4   6   3   9
   3   8   7   3   4   2   1   1   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    49  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    44    67    49    50    42  
   35    39    40    49  
   39    40    49  
   37    38  
   38  
    0  
   40    41    44    45    46    66    67    68    69    49    50    42    43  
   41    44    45    46    67    49    50    42    43  
   44    45    46    47    48    51    67    49    50    42    43  
   43    44    49  
    0  
   45    46    47    48    51    52    53    66    67    68    69    49    50    55  
   46    47    48    51    67    49    50  
   47    48    51    52    53    54    59    66    67    49    50    55    56    57    58  
   48    51    52    53    49    55  
   51    52    53    49    55  
   50    70    51    53    64    66    67    68    69  
   66    67    68    69  
   52    53    54    59    60    61    64    66    67    70    73    55    56    57    58  
   53    54    59    66    55    56    57    58  
   54    59    60    61    62    63    64    65    66    67    68    69    70    71    82    73    74    75    55    56    57    58  
   59    60    61    64    66    67    70    73    55  
   56    57    58    59    66  
   57    58  
   58  
    0  
   60    61    62    63    64    65    66    67    70    71    82    73    74    75  
   61    62    63    64    66    70    73    74    75  
   62    63    64    65    66    67    70    73    74    75  
   63    64    65    66    73  
   64    65    66    73  
   65    66    67    68    69    70    71    82    73  
   66    67    70  
   67    68    69    70    71    72    76    77    99    82    83    73    74    75  
   68    69    70    71    82    73  
   69    70  
   70  
   71    72    76    77    78    79    98    99   100    82    83   105    73    74    75  
   72    76    77    78    79    99    82    83    73    74    75  
   76    77    82    73  
   74    75    76    77    82    83    99  
   75    82  
   82  
   77    78    79    80    81    84    99    82    83  
   78    79    80    81    84    85    86    98    99   100    82    83   105    88  
   79    80    81    84    99    82    83  
   80    81    84    85    86    87    92    98    99    82    83    88    89    90    91  
   81    84    85    86    82    88  
   84    85    86    82    88  
   83   105   106   101    84    86    96    98    99   100  
  105    98    99   100  
   85    86    87    92    93    94    96    98    99   101    88    89    90    91  
   86    87    92    98    88    89    90    91  
   87    92    93    94    95    96    97    98    99   100   105   101   102   103   104    88    89    90    91  
   92    93    94    96    98    99   101    88  
   89    90    91    92    98  
   90    91  
   91  
    0  
   93    94    95    96    97    98    99   101  
   94    95    96    98  
   95    96    97    98    99   101  
   96    97    98  
   97    98    99   100   105   101   102   103   104  
   98    99   101  
   99   100   105   106   101   102   103   104  
  100   105   106   101   102   103   104  
  105   106   101  
  102   103   104   105  
  103   104  
  104  
    0  
  106  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760   0.133800   2.0020   1.7750   0.023028004  -0.852763146
   41   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   42   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   43   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   63   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   64   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   66   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   67   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   71   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   72   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   73   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   77   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   79   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   93   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   95   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   96   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   97   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   98   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   99   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  106   0.5000   0.0300   0.418000   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   317.000  1.510
   39    40   549.000  1.340
   39    49   317.000  1.510
   40    41   440.000  1.360
   40    42   510.000  1.338
   41    44   320.000  1.410
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    49   268.000  1.529
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    51   268.000  1.529
   51    52   340.000  1.090
   51    53   268.000  1.529
   51    55   268.000  1.529
   53    54   340.000  1.090
   53    59   268.000  1.529
   53    66   268.000  1.529
   59    60   340.000  1.090
   59    61   268.000  1.529
   59    73   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   317.000  1.522
   64    65   570.000  1.229
   64    66   317.000  1.522
   66    67   268.000  1.529
   66    70   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    49   268.000  1.529
   49    50   340.000  1.090
   70    71   317.000  1.522
   70    82   268.000  1.529
   70    73   268.000  1.529
   71    72   570.000  1.229
   71    76   214.000  1.327
   76    77   320.000  1.410
   77    78   340.000  1.090
   77    79   268.000  1.529
   77    82   268.000  1.529
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    84   268.000  1.529
   84    85   340.000  1.090
   84    86   268.000  1.529
   84    88   268.000  1.529
   86    87   340.000  1.090
   86    92   317.000  1.510
   86    98   268.000  1.529
   92    93   340.000  1.080
   92    94   549.000  1.340
   94    95   340.000  1.080
   94    96   320.000  1.462
   96    97   570.000  1.229
   96    98   317.000  1.522
   98    99   268.000  1.529
   98   101   268.000  1.529
   99   100   340.000  1.090
   99    82   268.000  1.529
   99   105   320.000  1.410
   82    83   340.000  1.090
  105   106   553.000  0.945
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   340.000  1.090
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    91   340.000  1.090
   73    74   340.000  1.090
   73    75   340.000  1.090
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   42    43   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  112.20000
   33    39    40    70.00000  124.00000
   33    39    49    65.00000  117.92700
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    40    41    80.00000  120.01400
   39    40    42    80.00000  121.38400
   39    49    44    70.00000  112.02700
   39    49    67    70.00000  112.02700
   39    49    50    35.00000  109.50000
   40    41    44    90.00000  111.18400
   40    42    43    70.00000  107.45700
   41    44    45    35.00000  109.50000
   41    44    46    50.00000  109.50000
   41    44    49    50.00000  109.50000
   44    46    47    37.50000  110.70000
   44    46    48    37.50000  110.70000
   44    46    51    58.35000  112.70000
   44    49    67    58.35000  112.70000
   44    49    50    37.50000  110.70000
   46    44    45    37.50000  110.70000
   46    51    52    37.50000  110.70000
   46    51    53    58.35000  112.70000
   46    51    55    58.35000  112.70000
   48    46    47    33.00000  107.80000
   51    46    47    37.50000  110.70000
   51    46    48    37.50000  110.70000
   51    53    54    37.50000  110.70000
   51    53    59    58.35000  112.70000
   51    53    66    58.35000  112.70000
   51    55    56    37.50000  110.70000
   51    55    57    37.50000  110.70000
   51    55    58    37.50000  110.70000
   53    51    52    37.50000  110.70000
   53    59    60    37.50000  110.70000
   53    59    61    58.35000  112.70000
   53    59    73    58.35000  112.70000
   53    66    64    63.00000  111.10000
   53    66    67    58.35000  112.70000
   53    66    70    58.35000  112.70000
   59    53    54    37.50000  110.70000
   59    61    62    37.50000  110.70000
   59    61    63    37.50000  110.70000
   59    61    64    63.00000  111.10000
   59    73    70    58.35000  112.70000
   59    73    74    37.50000  110.70000
   59    73    75    37.50000  110.70000
   61    59    60    37.50000  110.70000
   61    64    65    80.00000  120.40000
   61    64    66    70.00000  116.00000
   63    61    62    33.00000  107.80000
   64    61    62    35.00000  109.50000
   64    61    63    35.00000  109.50000
   64    66    67    63.00000  111.10000
   64    66    70    63.00000  111.10000
   66    53    54    37.50000  110.70000
   66    53    59    58.35000  112.70000
   66    64    65    80.00000  120.40000
   66    67    68    37.50000  110.70000
   66    67    69    37.50000  110.70000
   66    67    49    58.35000  112.70000
   66    70    71    63.00000  111.10000
   66    70    82    58.35000  112.70000
   66    70    73    58.35000  112.70000
   67    49    50    37.50000  110.70000
   69    67    68    33.00000  107.80000
   49    39    40    70.00000  124.00000
   49    44    45    37.50000  110.70000
   49    44    46    58.35000  112.70000
   49    67    68    37.50000  110.70000
   49    67    69    37.50000  110.70000
   70    66    67    58.35000  112.70000
   70    71    72    80.00000  120.40000
   70    71    76    81.00000  111.40000
   70    82    77    58.35000  112.70000
   70    82    99    58.35000  112.70000
   70    82    83    37.50000  110.70000
   70    73    74    37.50000  110.70000
   70    73    75    37.50000  110.70000
   71    76    77    83.00000  116.90000
   76    71    72    83.00000  123.40000
   76    77    78    35.00000  109.50000
   76    77    79    50.00000  109.50000
   76    77    82    50.00000  109.50000
   77    79    80    37.50000  110.70000
   77    79    81    37.50000  110.70000
   77    79    84    58.35000  112.70000
   77    82    99    58.35000  112.70000
   77    82    83    37.50000  110.70000
   79    77    78    37.50000  110.70000
   79    84    85    37.50000  110.70000
   79    84    86    58.35000  112.70000
   79    84    88    58.35000  112.70000
   81    79    80    33.00000  107.80000
   84    79    80    37.50000  110.70000
   84    79    81    37.50000  110.70000
   84    86    87    37.50000  110.70000
   84    86    92    70.00000  112.02700
   84    86    98    58.35000  112.70000
   84    88    89    37.50000  110.70000
   84    88    90    37.50000  110.70000
   84    88    91    37.50000  110.70000
   86    84    85    37.50000  110.70000
   86    92    93    35.00000  117.00000
   86    92    94    70.00000  124.00000
   86    98    96    63.00000  111.10000
   86    98    99    58.35000  112.70000
   86    98   101    58.35000  112.70000
   92    86    87    35.00000  109.50000
   92    94    95    35.00000  120.00000
   92    94    96    65.00000  118.96000
   94    92    93    35.00000  120.00000
   94    96    97    80.00000  123.72100
   94    96    98    65.00000  118.62400
   96    94    95    40.00000  117.72500
   96    98    99    63.00000  111.10000
   96    98   101    63.00000  111.10000
   98    86    87    37.50000  110.70000
   98    86    92    70.00000  112.02700
   98    96    97    80.00000  120.40000
   98    99   100    37.50000  110.70000
   98    99    82    58.35000  112.70000
   98    99   105    50.00000  109.50000
   98   101   102    37.50000  110.70000
   98   101   103    37.50000  110.70000
   98   101   104    37.50000  110.70000
   99    82    83    37.50000  110.70000
   99   105   106    55.00000  108.50000
   82    70    71    63.00000  111.10000
   82    77    78    37.50000  110.70000
   82    77    79    58.35000  112.70000
   82    99   100    37.50000  110.70000
  105    99   100    35.00000  109.50000
  105    99    82    50.00000  109.50000
  101    98    99    58.35000  112.70000
  103   101   102    33.00000  107.80000
  104   101   102    33.00000  107.80000
  104   101   103    33.00000  107.80000
   88    84    85    37.50000  110.70000
   88    84    86    58.35000  112.70000
   90    88    89    33.00000  107.80000
   91    88    89    33.00000  107.80000
   91    88    90    33.00000  107.80000
   73    59    60    37.50000  110.70000
   73    59    61    58.35000  112.70000
   73    70    71    63.00000  111.10000
   73    70    82    58.35000  112.70000
   75    73    74    33.00000  107.80000
   55    51    52    37.50000  110.70000
   55    51    53    58.35000  112.70000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   42    40    41   115.00000  116.36000
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
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   79    84    86    98  -0.07550 -1.0 2.0
   79    84    86    98   0.20000  1.0 3.0
   79    84    88    89   0.15000  1.0 3.0
   79    84    88    90   0.15000  1.0 3.0
   79    84    88    91   0.15000  1.0 3.0
   80    79    84    85   0.15000  1.0 3.0
   80    79    84    86   0.15000  1.0 3.0
   80    79    84    88   0.15000  1.0 3.0
   81    79    84    85   0.15000  1.0 3.0
   81    79    84    86   0.15000  1.0 3.0
   81    79    84    88   0.15000  1.0 3.0
   84    86    92    93   0.00000  1.0 1.0
   84    86    92    94   0.09850  1.0 1.0
   84    86    92    94   0.15250 -1.0 2.0
   84    86    92    94  -0.50650  1.0 3.0
   84    86    98    96  -0.95700  1.0 1.0
   84    86    98    96  -0.18200 -1.0 2.0
   84    86    98    96   0.29450  1.0 3.0
   84    86    98    99   0.56750  1.0 1.0
   84    86    98    99  -0.07550 -1.0 2.0
   84    86    98    99   0.20000  1.0 3.0
   84    86    98   101   0.56750  1.0 1.0
   84    86    98   101  -0.07550 -1.0 2.0
   84    86    98   101   0.20000  1.0 3.0
   85    84    86    87   0.15000  1.0 3.0
   85    84    86    92   0.15000  1.0 3.0
   85    84    86    98   0.15000  1.0 3.0
   85    84    88    89   0.15000  1.0 3.0
   85    84    88    90   0.15000  1.0 3.0
   85    84    88    91   0.15000  1.0 3.0
   86    84    88    89   0.15000  1.0 3.0
   86    84    88    90   0.15000  1.0 3.0
   86    84    88    91   0.15000  1.0 3.0
   86    92    94    95   7.00000 -1.0 2.0
   86    92   -94    96   7.00000 -1.0 2.0
   86    98    99   100   0.15000  1.0 3.0
   86    98    99    82   0.56750  1.0 1.0
   86    98    99    82  -0.07550 -1.0 2.0
   86    98    99    82   0.20000  1.0 3.0
   86    98    99   105   0.86500  1.0 1.0
   86    98    99   105  -0.17500 -1.0 2.0
   86    98    99   105   0.20800  1.0 3.0
   86    98   101   102   0.15000  1.0 3.0
   86    98   101   103   0.15000  1.0 3.0
   86    98   101   104   0.15000  1.0 3.0
   87    86    92    93   0.33100  1.0 3.0
   87    86    92    94   0.00000  1.0 1.0
   87    86    98    96  -0.11250  1.0 3.0
   87    86    98    99   0.15000  1.0 3.0
   87    86    98   101   0.15000  1.0 3.0
   92    86   -98    96  -0.98800  1.0 1.0
   92    86   -98    96   0.48800 -1.0 2.0
   92    86   -98    96   0.76800  1.0 3.0
   92    86    98    99   0.34400  1.0 1.0
   92    86    98    99   0.09450 -1.0 2.0
   92    86    98    99   0.11100  1.0 3.0
   92    86    98   101   0.34400  1.0 1.0
   92    86    98   101   0.09450 -1.0 2.0
   92    86    98   101   0.11100  1.0 3.0
   92    94    96    97   1.00000 -1.0 2.0
   92    94   -96    98  -0.33500  1.0 1.0
   92    94   -96    98   1.06600 -1.0 2.0
   92    94   -96    98  -0.14000  1.0 3.0
   93    92    94    95   7.00000 -1.0 2.0
   93    92    94    96   7.00000 -1.0 2.0
   94    96   -98    86   0.65300  1.0 1.0
   94    96   -98    86  -0.03850 -1.0 2.0
   94    96   -98    86   0.33900  1.0 3.0
   94    96    98    99   0.65300  1.0 1.0
   94    96    98    99  -0.03850 -1.0 2.0
   94    96    98    99   0.33900  1.0 3.0
   94    96    98   101   0.65300  1.0 1.0
   94    96    98   101  -0.03850 -1.0 2.0
   94    96    98   101   0.33900  1.0 3.0
   95    94    96    97   0.00000  1.0 1.0
   95    94    96    98   0.04550  1.0 1.0
   95    94    96    98   0.83000 -1.0 2.0
   95    94    96    98  -0.04000  1.0 3.0
   96    98    99   100  -0.11250  1.0 3.0
   96    98    99    82  -0.95700  1.0 1.0
   96    98    99    82  -0.18200 -1.0 2.0
   96    98    99    82   0.29450  1.0 3.0
   96    98    99   105  -0.09450  1.0 1.0
   96    98    99   105  -1.12950 -1.0 2.0
   96    98    99   105   0.54000  1.0 3.0
   96    98   101   102  -0.11250  1.0 3.0
   96    98   101   103  -0.11250  1.0 3.0
   96    98   101   104  -0.11250  1.0 3.0
   97    96    98    86   0.30150 -1.0 2.0
   97    96    98    99   0.30150 -1.0 2.0
   97    96    98   101   0.30150 -1.0 2.0
   98    86    92    93   0.00000  1.0 1.0
   98    86   -92    94   0.09850  1.0 1.0
   98    86   -92    94   0.15250 -1.0 2.0
   98    86   -92    94  -0.50650  1.0 3.0
   98    99    82    70   0.56750  1.0 1.0
   98    99    82    70  -0.07550 -1.0 2.0
   98    99    82    70   0.20000  1.0 3.0
   98    99    82    77   0.56750  1.0 1.0
   98    99    82    77  -0.07550 -1.0 2.0
   98    99    82    77   0.20000  1.0 3.0
   98    99    82    83   0.15000  1.0 3.0
   98    99   105   106  -0.11600  1.0 1.0
   98    99   105   106  -0.09450 -1.0 2.0
   98    99   105   106   0.21250  1.0 3.0
   99    98   101   102   0.15000  1.0 3.0
   99    98   101   103   0.15000  1.0 3.0
   99    98   101   104   0.15000  1.0 3.0
  100    99    82    70   0.15000  1.0 3.0
  100    99    82    77   0.15000  1.0 3.0
  100    99    82    83   0.15000  1.0 3.0
  100    99   105   106   0.19450  1.0 3.0
   82    70    71    72   0.30150 -1.0 2.0
   82    70   -71    76   0.36750  1.0 3.0
   82    70    73    59   0.56750  1.0 1.0
   82    70    73    59  -0.07550 -1.0 2.0
   82    70    73    59   0.20000  1.0 3.0
   82    70    73    74   0.15000  1.0 3.0
   82    70    73    75   0.15000  1.0 3.0
   82    77    79    80   0.15000  1.0 3.0
   82    77    79    81   0.15000  1.0 3.0
   82    77    79    84   0.56750  1.0 1.0
   82    77    79    84  -0.07550 -1.0 2.0
   82    77    79    84   0.20000  1.0 3.0
   82    99   105   106  -0.11600  1.0 1.0
   82    99   105   106  -0.09450 -1.0 2.0
   82    99   105   106   0.21250  1.0 3.0
  105    99    82    70   0.86500  1.0 1.0
  105    99    82    70  -0.17500 -1.0 2.0
  105    99    82    70   0.20800  1.0 3.0
  105    99    82    77   0.86500  1.0 1.0
  105    99    82    77  -0.17500 -1.0 2.0
  105    99    82    77   0.20800  1.0 3.0
  105    99    82    83   0.23400  1.0 3.0
  101    98    99   100   0.15000  1.0 3.0
  101    98    99    82   0.56750  1.0 1.0
  101    98    99    82  -0.07550 -1.0 2.0
  101    98    99    82   0.20000  1.0 3.0
  101    98    99   105   0.86500  1.0 1.0
  101    98    99   105  -0.17500 -1.0 2.0
  101    98    99   105   0.20800  1.0 3.0
   88    84    86    87   0.15000  1.0 3.0
   88    84    86    92   0.34400  1.0 1.0
   88    84    86    92   0.09450 -1.0 2.0
   88    84    86    92   0.11100  1.0 3.0
   88    84    86    98   0.56750  1.0 1.0
   88    84    86    98  -0.07550 -1.0 2.0
   88    84    86    98   0.20000  1.0 3.0
   73    59    61    62   0.15000  1.0 3.0
   73    59    61    63   0.15000  1.0 3.0
   73    59   -61    64  -0.95700  1.0 1.0
   73    59   -61    64  -0.18200 -1.0 2.0
   73    59   -61    64   0.29450  1.0 3.0
   73    70    71    72   0.30150 -1.0 2.0
   73    70    71    76   0.36750  1.0 3.0
   73    70    82    77   0.56750  1.0 1.0
   73    70    82    77  -0.07550 -1.0 2.0
   73    70    82    77   0.20000  1.0 3.0
   73    70    82    99   0.56750  1.0 1.0
   73    70    82    99  -0.07550 -1.0 2.0
   73    70    82    99   0.20000  1.0 3.0
   73    70    82    83   0.15000  1.0 3.0
   55    51    53    54   0.15000  1.0 3.0
   55    51    53    59   0.56750  1.0 1.0
   55    51    53    59  -0.07550 -1.0 2.0
   55    51    53    59   0.20000  1.0 3.0
   55    51    53    66   0.56750  1.0 1.0
   55    51    53    66  -0.07550 -1.0 2.0
   55    51    53    66   0.20000  1.0 3.0
   42    40    41    44   2.00000 -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
   37    30    36    38  10.50000 -1.0 2.0
   33    49    39    40   1.10000 -1.0 2.0
   41    42    40    39   1.10000 -1.0 2.0
   61    66    64    65  10.50000 -1.0 2.0
   70    76    71    72  10.50000 -1.0 2.0
   86    93    92    94   1.10000 -1.0 2.0
   96    95    94    92   1.10000 -1.0 2.0
   94    98    96    97  10.50000 -1.0 2.0
END
