* LIGAND DATABASE FILE (OPLS2005)
*
001     103   107    202    324     600
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02058    51.19989    94.97098
    3     1 S   H    _H1_     3     1.02145    61.04615  -108.89520
    4     1 S   H    _H2_     4     1.02040   106.31430    -6.21792
    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     1.08519   110.61667    58.74867
   26    24 S   HC   HB22    34     1.08584   110.00631   179.14591
   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   _C20    36     1.86177    96.89957  -158.12757
   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   CM   _C15    37     1.54036   107.65419  -159.98314
   38    33 S   CT   _C21    86     1.54082   107.27688    77.64619
   39    38 S   HC   _H21    87     1.09807   111.57115   -44.68869
   40    38 S   HC   _H22    88     1.09932   109.78799  -161.07711
   41    37 S   CM   _C14    38     1.36424   122.87111  -109.74195
   42    37 S   CT   _C16    93     1.52843   113.35176    70.43540
   43    42 S   HC   _H15    94     1.09226   113.07642   174.65804
   44    42 S   HC   _H16    95     1.09692   109.16858   -68.20718
   45    41 S   CT   _C13    39     1.54402   122.04908   177.25377
   46    45 S   HC   _H4_    40     1.12027   107.71340   -34.19168
   47    42 S   CT   _C17    96     1.52239   112.44625    53.80173
   48    47 S   HC   _H17    97     1.09425   109.97291  -174.07414
   49    47 S   HC   _H18    98     1.09572   111.32197    66.19484
   50    45 S   CA   _C24    41     1.52602   112.96748    81.66870
   51    45 S   CT   _C12    60     1.55555   117.07043  -149.32681
   52    51 S   HC   _H13    61     1.09898   109.30581   138.27444
   53    51 S   HC   _H14    62     1.09824   108.68035  -107.70276
   54    47 S   CO4  _C18    99     1.50686   110.06793   -53.88276
   55    54 S   O    _O33   100     1.22911   122.01874  -132.00473
   56    50 S   CA   _C25    42     1.39477   120.05205  -117.27121
   57    56 S   HA   _H25    43     1.08684   120.49243     0.02798
   58    51 S   CT   _C11    63     1.53625   113.55748    15.10628
   59    33 S   CT   _C19   101     1.54395   108.69141   -38.68248
   60    59 S   HC   _H19   102     1.09859   110.46467   168.90316
   61    59 S   HC   _H20   103     1.09716   111.46129    50.32506
   62    56 S   CA   _C26    44     1.39463   120.00703   180.00000
   63    62 S   HA   _H26    45     1.08744   119.40675  -179.91153
   64    58 S   CT   _C10    64     1.53926   106.60368   -56.74085
   65    64 S   HC   _H3_    65     1.10378   107.07166   -54.78721
   66    58 S   CT   _C32    89     1.55202   109.75000    66.77500
   67    66 S   HC   _H35    90     1.08083   108.60679   180.00000
   68    66 S   HC   _H36    91     1.08096   108.61399    59.99115
   69    66 S   HC   _H37    92     1.08089   108.57807   -59.97909
   70    62 S   CA   _C27    46     1.39455   119.99153     0.00000
   71    64 S   CT   _C9_    66     1.53235   103.77979  -165.35783
   72    71 S   HC   _H11    67     1.09401   112.47804   -86.81561
   73    71 S   HC   _H12    68     1.09548   111.49854   152.20451
   74    41 S   CT   _C23    81     1.53863   121.00113     0.77380
   75    74 S   HC   _H5_    82     1.10259   104.34975   -93.76053
   76    70 S   CA   _C28    47     1.39506   120.02110    -0.03956
   77    76 S   HA   _H27    48     1.08696   120.62696  -179.95577
   78    70 S   NE   _N4_    51     1.41041   120.02098   179.96574
   79    71 S   CT   _C8_    69     1.54135   105.39512    31.27061
   80    79 S   HC   _H9_    70     1.09658   110.38660   116.63425
   81    79 S   HC   _H10    71     1.09643   109.50410  -126.68915
   82    74 S   CT   _C22    83     1.53396   113.01496    20.43129
   83    82 S   HC   _H23    84     1.09653   110.02134  -169.22751
   84    82 S   HC   _H24    85     1.09537   110.94566    72.22223
   85    50 S   CA   _C29    49     1.39455   119.94651    62.72765
   86    85 S   HA   _H28    50     1.08703   120.54012    -0.10835
   87    78 S   CT   _C30    52     1.45007   120.44076    -0.04423
   88    87 S   HC   _H29    53     1.09264   110.10651  -179.96044
   89    87 S   HC   _H30    54     1.09313   110.18714    59.96940
   90    87 S   HC   _H31    55     1.09403   110.19891   -59.92846
   91    78 S   CT   _C31    56     1.44927   120.45192   179.36511
   92    91 S   HC   _H32    57     1.09334   110.12148   180.00000
   93    91 S   HC   _H33    58     1.09351   110.23228    59.92884
   94    91 S   HC   _H34    59     1.09356   110.16858   -60.02772
   95    58 S   CT   _C7_    72     1.56642   115.73346  -168.01940
   96    95 S   CZ   _C6_    73     1.47760   113.70436    36.42610
   97    95 S   OH   _O34    79     1.42056   112.56010   -85.44887
   98    97 S   HO   _H38    80     0.97063   106.82968  -174.44610
   99    96 S   CZ   _C5_    74     1.20056   180.00000   -69.75614
  100    99 S   CT   _C4_    75     1.46178   179.94405   177.38237
  101   100 S   HC   _H6_    76     1.09437   110.88897  -175.77061
  102   100 S   HC   _H7_    77     1.09394   110.88870    64.22515
  103   100 S   HC   _H8_    78     1.09468   110.90135   -55.76829
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  12   5   4   3
  19   2   1   1  22  14   6   5  22  10   5   4  18   8   7   4
   3  14  17   5   4   4   3   8   4  20   3   1   1   8   3  19
   9   9   3   2   1  13  11   6   5   6   3   6   3   9   7   4
   3   2   1   1   1   1   7   3   2   1   3   2   1   1   5   7
   2   1   4   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    38    59    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    82    38    39    40    42    54    59    60    61  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    45    74    82    83    84    38    39    40    42    43    44    47    54    55    59    60    61  
   35    36  
   36  
    0  
   41    45    46    50    51    64    74    75    82    38    39    40    42    43    44    47    48    49    54    59    60    61  
   39    40    42    54    59    60    61    41    64    74    75    82    83    84  
   40    59    74    82    83    84  
   59    74    82    83    84  
   45    46    50    56    85    51    52    53    58    64    65    71    74    75    82    83    84    42    43    44    47    59  
   43    44    47    48    49    54    55    59    45    74  
   44    47    48    49    54  
   47    48    49    54  
   46    50    56    57    62    76    85    86    51    52    53    58    64    95    74    75    82    66  
   50    56    85    51    52    53    58    74  
   48    49    54    55    59    60    61  
   49    54    55    59  
   54    55    59  
   56    57    62    63    70    76    77    85    86    51    52    53    58    74  
   52    53    58    64    65    71    79    95    96    97    74    66    67    68    69    56    85  
   53    58    64    95    66  
   58    64    95    66  
   55    59    60    61  
   59    60    61  
   57    62    63    70    76    85    86    78  
   62    63    70    85  
   64    65    71    72    73    79    80    81    95    96    99    97    98    74    75    82    66    67    68    69  
   60    61    82  
   61  
    0  
   63    70    76    77    85    78    87    91  
   70    76    78  
   65    71    72    73    79    80    81    95    96    97    74    75    82    83    84    66    67    68    69  
   71    72    73    79    95    74    75    82    66  
   67    68    69    71    74    79    95    96    97  
   68    69    95  
   69    95  
   95  
   76    77    85    86    78    87    88    89    90    91    92    93    94  
   72    73    79    80    81    95    96    97    74    75    82  
   73    79    80    81    95    74  
   79    80    81    95    74  
   75    82    83    84    79    95  
   82    83    84  
   77    85    86    78    87    91  
   85    86    78  
   87    88    89    90    91    92    93    94    85  
   80    81    95    96    99    97    98  
   81    95    96    97  
   95    96    97  
   83    84  
   84  
    0  
   86  
    0  
   88    89    90    91    92    93    94  
   89    90    91  
   90    91  
   91  
   92    93    94  
   93    94  
   94  
    0  
   96    99   100    97    98  
   99   100   101   102   103    97    98  
   98    99  
    0  
  100   101   102   103  
  101   102   103  
  102   103  
  103  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   42   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   55   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   59   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0700   0.210000   2.5000   1.7750   0.001000000  -0.843144165
   71   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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
   74   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   77   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   78   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   86   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   87   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   96   3.6500   0.1500   0.000000   2.0580   1.8250   0.025318638  -1.264311570
   97   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   98   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   99   3.6500   0.1500   0.000000   2.0580   1.8250   0.025318638  -1.264311570
  100   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  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
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    38   268.000  1.529
   33    59   268.000  1.529
   37    41   549.000  1.340
   37    42   317.000  1.510
   41    45   317.000  1.510
   41    74   317.000  1.510
   45    46   340.000  1.090
   45    50   317.000  1.510
   45    51   268.000  1.529
   50    56   469.000  1.400
   50    85   469.000  1.400
   56    57   367.000  1.080
   56    62   469.000  1.400
   62    63   367.000  1.080
   62    70   469.000  1.400
   70    76   469.000  1.400
   70    78   481.000  1.340
   76    77   367.000  1.080
   76    85   469.000  1.400
   85    86   367.000  1.080
   78    87   382.000  1.448
   78    91   382.000  1.448
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    90   340.000  1.090
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    94   340.000  1.090
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    58   268.000  1.529
   58    64   268.000  1.529
   58    95   268.000  1.529
   58    66   268.000  1.529
   64    65   340.000  1.090
   64    71   268.000  1.529
   64    74   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    79   268.000  1.529
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    95   268.000  1.529
   95    96   390.000  1.470
   95    97   320.000  1.410
   96    99   985.000  1.221
   99   100   390.000  1.470
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   340.000  1.090
   97    98   553.000  0.945
   74    75   340.000  1.090
   74    82   268.000  1.529
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    38   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    47   268.000  1.529
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    54   317.000  1.522
   54    55   570.000  1.229
   54    59   317.000  1.522
   59    60   340.000  1.090
   59    61   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    38    75.00000  111.63000
   29    33    59    75.00000  111.63000
   33    37    41    70.00000  124.00000
   33    37    42    65.00000  117.92700
   33    38    82    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    59    54    63.00000  111.10000
   33    59    60    37.50000  110.70000
   33    59    61    37.50000  110.70000
   37    41    45    70.00000  124.00000
   37    41    74    70.00000  124.00000
   37    42    43    35.00000  109.50000
   37    42    44    35.00000  109.50000
   37    42    47    70.00000  112.02700
   41    45    46    35.00000  109.50000
   41    45    50    70.00000  112.99600
   41    45    51    70.00000  112.02700
   41    74    64    70.00000  112.02700
   41    74    75    35.00000  109.50000
   41    74    82    70.00000  112.02700
   45    50    56    70.00000  120.00000
   45    50    85    70.00000  120.00000
   45    51    52    37.50000  110.70000
   45    51    53    37.50000  110.70000
   45    51    58    58.35000  112.70000
   50    45    46    35.00000  109.50000
   50    56    57    35.00000  120.00000
   50    56    62    63.00000  120.00000
   50    85    76    63.00000  120.00000
   50    85    86    35.00000  120.00000
   56    62    63    35.00000  120.00000
   56    62    70    63.00000  120.00000
   62    56    57    35.00000  120.00000
   62    70    76    63.00000  120.00000
   62    70    78    70.00000  120.10000
   70    62    63    35.00000  120.00000
   70    76    77    35.00000  120.00000
   70    76    85    63.00000  120.00000
   70    78    87    50.00000  120.00000
   70    78    91    50.00000  120.00000
   76    85    86    35.00000  120.00000
   85    50    56    63.00000  120.00000
   85    76    77    35.00000  120.00000
   78    70    76    70.00000  120.10000
   78    87    88    35.00000  109.50000
   78    87    89    35.00000  109.50000
   78    87    90    35.00000  109.50000
   78    91    92    35.00000  109.50000
   78    91    93    35.00000  109.50000
   78    91    94    35.00000  109.50000
   89    87    88    33.00000  107.80000
   90    87    88    33.00000  107.80000
   90    87    89    33.00000  107.80000
   91    78    87    50.00000  115.00000
   93    91    92    33.00000  107.80000
   94    91    92    33.00000  107.80000
   94    91    93    33.00000  107.80000
   51    45    46    37.50000  110.70000
   51    45    50    70.00000  112.17500
   51    58    64    58.35000  112.70000
   51    58    95    58.35000  112.70000
   51    58    66    58.35000  112.70000
   53    51    52    33.00000  107.80000
   58    51    52    37.50000  110.70000
   58    51    53    37.50000  110.70000
   58    64    65    37.50000  110.70000
   58    64    71    58.35000  112.70000
   58    64    74    58.35000  112.70000
   58    95    79    58.35000  112.70000
   58    95    96    58.35000  112.70000
   58    95    97    50.00000  109.50000
   58    66    67    37.50000  110.70000
   58    66    68    37.50000  110.70000
   58    66    69    37.50000  110.70000
   64    71    72    37.50000  110.70000
   64    71    73    37.50000  110.70000
   64    71    79    58.35000  112.70000
   64    74    75    37.50000  110.70000
   64    74    82    58.35000  112.70000
   71    64    65    37.50000  110.70000
   71    79    80    37.50000  110.70000
   71    79    81    37.50000  110.70000
   71    79    95    58.35000  112.70000
   73    71    72    33.00000  107.80000
   79    71    72    37.50000  110.70000
   79    71    73    37.50000  110.70000
   79    95    96    58.35000  112.70000
   79    95    97    50.00000  109.50000
   81    79    80    33.00000  107.80000
   95    58    64    58.35000  112.70000
   95    79    80    37.50000  110.70000
   95    79    81    37.50000  110.70000
   95    96    99    30.00000  179.48800
   95    97    98    55.00000  108.50000
   96    99   100    30.00000  179.48800
   99   100   101    35.00000  108.50000
   99   100   102    35.00000  108.50000
   99   100   103    35.00000  108.50000
  102   100   101    33.00000  107.80000
  103   100   101    33.00000  107.80000
  103   100   102    33.00000  107.80000
   97    95    96    90.00000  111.78800
   74    41    45    65.00000  117.92700
   74    64    65    37.50000  110.70000
   74    64    71    58.35000  112.70000
   74    82    83    37.50000  110.70000
   74    82    84    37.50000  110.70000
   74    82    38    58.35000  112.70000
   82    74    75    37.50000  110.70000
   82    38    39    37.50000  110.70000
   82    38    40    37.50000  110.70000
   84    82    83    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    82    83    37.50000  110.70000
   38    82    84    37.50000  110.70000
   40    38    39    33.00000  107.80000
   66    58    64    58.35000  112.70000
   66    58    95    58.35000  112.70000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
   42    37    41    70.00000  124.00000
   42    47    48    37.50000  110.70000
   42    47    49    37.50000  110.70000
   42    47    54    63.00000  111.10000
   44    42    43    33.00000  107.80000
   47    42    43    37.50000  110.70000
   47    42    44    37.50000  110.70000
   47    54    55    80.00000  120.40000
   47    54    59    70.00000  116.00000
   49    47    48    33.00000  107.80000
   54    47    48    35.00000  109.50000
   54    47    49    35.00000  109.50000
   54    59    60    35.00000  109.50000
   54    59    61    35.00000  109.50000
   59    33    37    70.00000  112.02700
   59    33    38    58.35000  112.70000
   59    54    55    80.00000  120.40000
   61    59    60    33.00000  107.80000
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
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   59    33   -37    42   0.46850  1.0 1.0
   59    33   -37    42   0.08550 -1.0 2.0
   59    33   -37    42   0.09800  1.0 3.0
   59    33    38    82   0.56750  1.0 1.0
   59    33    38    82  -0.07550 -1.0 2.0
   59    33    38    82   0.20000  1.0 3.0
   59    33    38    39   0.15000  1.0 3.0
   59    33    38    40   0.15000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    42    37    41   1.10000 -1.0 2.0
   45    74    41    37   1.10000 -1.0 2.0
   56    85    50    45   4.00000 -1.0 2.0
   62    57    56    50   1.10000 -1.0 2.0
   70    63    62    56   1.10000 -1.0 2.0
   76    78    70    62   4.00000 -1.0 2.0
   85    77    76    70   1.10000 -1.0 2.0
   76    86    85    50   1.10000 -1.0 2.0
   91    70    78    87   1.00000 -1.0 2.0
   47    59    54    55  10.50000 -1.0 2.0
END
