* LIGAND DATABASE FILE (OPLS2005)
*
001     107   111    206    340     622
    1     0 S   NP   _N1_     1    28.78151    94.97026   -24.01021
    2     1 S   H    _HN1     2     1.02778   107.31994   -86.25231
    3     1 S   H    _H1_     3     1.02959    80.26557    20.05252
    4     1 S   H    _H2_     4     1.02837    28.88461   177.95637
    5     1 S   CT   _CA1     5     1.50139   132.20215   128.79729
    6     5 S   HC   _HA1     6     1.09577   105.19458    82.18717
    7     5 S   CO3  _C1_     7     1.53766   112.35421   -37.93231
    8     7 S   O2Z  _O11     8     1.26359   114.99193   -44.00337
    9     7 S   O2Z  _O12     9     1.26235   114.91151   135.00404
   10     5 S   CT   _CB1    10     1.53086   107.40857  -159.97487
   11    10 S   HC   HB11    11     1.09828   109.23385   -50.92759
   12    10 S   HC   HB12    12     1.09815   110.45958    65.58913
   13    10 S   CT   _CG1    13     1.53027   112.72762  -172.03036
   14    13 S   HC   HG11    14     1.09593   110.47881   -65.54183
   15    13 S   HC   HG12    15     1.09657   109.93796    53.69008
   16    13 S   C    _CD1    16     1.51825   112.26844   173.95616
   17    16 S   O    _OE1    17     1.22755   123.29864     0.08847
   18    16 S   N    _N2_    18     1.38612   111.78716  -179.40127
   19    18 S   H    _HN2    19     1.01584   119.04997     1.58227
   20    18 S   CT1  _CA2    20     1.46070   123.34367   179.12107
   21    20 S   HC   _HA2    21     1.09786   109.37676     5.83251
   22    20 S   C    _C2_    22     1.53374   108.19378  -109.49098
   23    22 S   O    _O2_    23     1.23023   122.37444  -137.17686
   24    20 S   CT   _CB2    32     1.53389   111.94230   127.65194
   25    24 S   HC   HB21    33     1.09540   110.06401    55.72296
   26    24 S   HC   HB22    34     1.09285   109.23612   174.58405
   27    22 S   N    _N3_    24     1.38530   113.38276    50.16821
   28    27 S   H    _HN3    25     1.01489   119.24092    -1.16785
   29    24 S   S    _SG2    35     1.83211   110.84518   -65.22226
   30    27 S   CT   _CA3    26     1.45378   123.00997   173.90143
   31    30 S   HC   HA31    27     1.09533   109.21444    30.62952
   32    30 S   HC   HA32    28     1.09495   107.33777   147.63999
   33    29 S   CT   _C20    36     1.89201   102.24248  -169.98950
   34    33 S   OM   _O36    37     1.32050   106.76558   -57.30195
   35    30 S   CO3  _C3_    29     1.52825   112.30290   -92.48869
   36    35 S   O2Z  _O31    30     1.26425   115.04983   -60.61522
   37    35 S   O2Z  _O32    31     1.26295   115.28642   119.50366
   38    33 S   CT   _C21    38     1.56267   111.59155    60.67933
   39    38 S   HC   _H6_    39     1.10274   108.24493   -76.87940
   40    38 S   CO4  _C22    40     1.53576   114.18861   168.13216
   41    40 S   O    _O34    41     1.23652   118.65762   169.78342
   42    38 S   C    _C23    87     1.54035   114.50544    42.21442
   43    42 S   O    _O35    88     1.22842   123.58014    41.51095
   44    40 S   CT   _C15    42     1.53841   119.45493   -10.21321
   45    42 S   N    _N4_    89     1.38760   112.91765  -140.08538
   46    45 S   H    _H15    90     1.01514   119.73247    -0.70831
   47    44 S   CM   _C14    43     1.52327   109.63985  -163.08593
   48    44 S   CT   _C16    64     1.53824   111.33302   -38.22593
   49    48 S   HC   _H3_    65     1.09668   106.69231   167.22873
   50    44 S   OH   _O37    85     1.42625   108.34236    80.67034
   51    50 S   HO   _H33    86     0.97321   107.67995    66.61673
   52    45 S   CT   _C24    91     1.44121   122.12556   179.48833
   53    52 S   HC   _H16    92     1.09401   109.92177   152.65203
   54    52 S   HC   _H17    93     1.09462   110.10899    30.62803
   55    47 S   CM   _C13    44     1.35190   123.67908   108.85153
   56    33 S   CT   _C19    66     1.58906   107.40838  -177.74163
   57    56 S   HC   _H5_    67     1.09969   101.55303   -49.91165
   58    47 S   OH   _O38    83     1.38803   112.60754   -73.41289
   59    58 S   HO   _H34    84     0.97301   108.91862  -179.62361
   60    52 S   NP   _N5_    94     1.49524   109.56500   -87.71661
   61    60 S   H    _H18    95     1.02917   106.00748    48.39352
   62    55 S   CO4  _C12    45     1.49749   120.23199   176.98533
   63    62 S   O    _O33    46     1.22721   121.98820    -5.38962
   64    56 S   NT   _N6_    68     1.49760   115.24913    60.32227
   65    60 S   CT   _C25    96     1.51182   114.91504   -69.49215
   66    65 S   HC   _H19    97     1.09108   108.71745    82.51885
   67    65 S   HC   _H20    98     1.09531   108.16995   -37.92468
   68    62 S   CA   _C11    47     1.48583   118.42934   175.30493
   69    64 S   CT   _C29    69     1.46374   112.62472  -147.53798
   70    69 S   HC   _H27    70     1.09612   110.43133   172.12471
   71    69 S   HC   _H28    71     1.09555   111.10802    54.64404
   72    69 S   HC   _H29    72     1.09510   112.33255   -67.25523
   73    64 S   CT   _C30    73     1.46220   116.08997    84.95714
   74    73 S   HC   _H30    74     1.09672   109.48538  -167.70570
   75    73 S   HC   _H31    75     1.09476   113.08824    73.03939
   76    73 S   HC   _H32    76     1.09121   113.18969   -50.14818
   77    65 S   CT   _C26    99     1.51191   102.90209  -156.28371
   78    77 S   HC   _H21   100     1.09639   110.54630   -76.94033
   79    77 S   HC   _H22   101     1.09295   112.34117   161.72072
   80    68 S   CA   _C6_    48     1.41040   120.02941   -16.95345
   81    77 S   CT   _C27   102     1.51528   102.58146    40.88938
   82    81 S   HC   _H23   103     1.09682   110.02814    78.70189
   83    81 S   HC   _H24   104     1.09385   112.57091  -161.22256
   84    80 S   CA   _C7_    49     1.40881   117.98288  -178.22018
   85    84 S   HA   _H10    50     1.08582   121.56538   178.88180
   86    80 S   CT   _C5_    58     1.52811   120.09835    -0.00000
   87    60 S   CT   _C28   105     1.51588   114.56868   165.73501
   88    87 S   HC   _H25   106     1.09429   109.72143    11.53620
   89    87 S   HC   _H26   107     1.09434   106.71020  -107.99334
   90    84 S   CA   _C8_    51     1.39587   121.56149    -0.99956
   91    90 S   HA   _H11    52     1.08645   119.94952  -179.69610
   92    55 S   CT   _C18    59     1.51361   123.21275    -1.71269
   93    92 S   HC   _H4_    60     1.10125   106.47906   104.15442
   94    86 S   CT   _C4_    77     1.54152   113.61087   160.95911
   95    94 S   HC   _H7_    78     1.09499   111.77456   177.18297
   96    94 S   HC   _H8_    79     1.09597   111.65789    61.41790
   97    94 S   HC   _H9_    80     1.09500   111.77318   -60.71939
   98    86 S   OH   _O40    81     1.43530   108.15937   -81.55761
   99    98 S   HO   _H36    82     0.97266   108.21370   -45.96364
  100    90 S   CA   _C9_    53     1.38713   120.01901     0.49377
  101   100 S   HA   _H12    54     1.08653   119.84084   179.95154
  102    92 S   CT   _C17    61     1.54240   111.73571   -12.05571
  103   102 S   HC   _H13    62     1.09547   108.70989   163.72542
  104   102 S   HC   _H14    63     1.09513   109.79497   -79.69996
  105    68 S   CA   _C10    55     1.40876   120.06877   164.09764
  106   105 S   OH   _O39    56     1.37011   123.66114    -1.40889
  107   106 S   HO   _H35    57     0.97337   108.98144     3.97296
  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   8   2   1   1  15   7  14   5   9   3  16   8   4  15  16
   8   5   1  12   5   4  15  14   4   3   1  13   8  11   4   9
  11   6   5  13   7   3   2   1   3   2   1   1   8   5   4  17
   5   4   3  10   4  13   2   1   1   5   3  10   5   6   3   2
   1   2   1   4   2   2   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    56    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    48    56    57    64    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44   102    48    49    56    57    64    69    73    42    43    45  
   38    39    40    48    56    57    64    42  
   36    37  
   37  
    0  
   39    40    41    44    47    48    56    57    64    50    42    43    45    46    52  
   40    41    44    56    42    43    45  
   41    44    47    55   102    48    49    56    58    50    51    42    43    45  
   44    47    48    50    42  
   43    45    46    52    53    54    60    44    56  
   45    46    52  
   47    55    62    92   102   103   104    48    49    56    57    64    58    59    50    51  
   46    52    53    54    60    61    65    87  
   52    53    54    60  
   55    62    63    68    86    92    93   102    48    49    56    58    59    50    51  
   49    56    57    64    69    73    58    50    51    55    86    92    93   102   103   104  
   56    57    64    50    92   102   103   104  
   51    55    56    58   102  
    0  
   53    54    60    61    65    66    67    77    81    87    88    89  
   54    60    61    65    87  
   60    61    65    87  
   62    63    68    80   105    86    92    93   102   103   104    94    98    58    59  
   57    64    69    70    71    72    73    74    75    76    92   102   103   104  
   64    69    73   102  
   59    62    92  
    0  
   61    65    66    67    77    78    79    81    82    83    87    88    89  
   65    66    67    77    81    87    88    89  
   63    68    80    84   100   105   106    86    92    93   102  
   68    80   105    92  
   69    70    71    72    73    74    75    76   102  
   66    67    77    78    79    81    82    83    87    88    89  
   67    77    78    79    81    87  
   77    78    79    81    87  
   80    84    85    90   100   101   105   106   107    86    92    94    98  
   70    71    72    73    74    75    76  
   71    72    73  
   72    73  
   73  
   74    75    76  
   75    76  
   76  
    0  
   78    79    81    82    83    87    88    89  
   79    81    82    83    87  
   81    82    83    87  
   84    85    90    91   100   105   106    86    92    93   102    94    95    96    97    98    99  
   82    83    87    88    89  
   83    87    88    89  
   87    88    89  
   85    90    91   100   101   105    86    92    94    98  
   90    91   100    86  
   92    93   102   103   104    94    95    96    97    98    99    90   105  
   88    89  
   89  
    0  
   91   100   101   105   106  
  100   101   105  
   93   102   103   104    94    95    96    97    98    99  
  102   103   104    94    98  
   95    96    97    98    99   102  
   96    97    98  
   97    98  
   98  
   99   102  
    0  
  101   105   106   107  
  105   106  
  103   104  
  104  
    0  
  106   107  
  107  
    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  -0.175000   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   4.2000   0.3000  -0.012500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   44   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   45   3.2500   0.1700  -0.422500   1.8100   1.6000   0.054801302  -1.445846770
   46   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   47   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5000   0.0660   0.272500   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   56   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   60   3.2500   0.1700  -0.100000   2.2900   2.0360   0.003973653   1.685851020
   61   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   64   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   65   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   68   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   69   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   80   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   81   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   84   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   85   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   86   3.5000   0.0660   0.380000   1.9750   1.7500   0.005000000  -0.741685710
   87   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   90   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   91   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   92   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   99   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  100   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  101   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  102   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  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   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
  106   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
  107   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   570.000  1.307
   33    38   268.000  1.529
   33    56   268.000  1.529
   38    39   340.000  1.090
   38    40   317.000  1.522
   38    42   317.000  1.522
   40    41   570.000  1.229
   40    44   317.000  1.522
   44    47   317.000  1.510
   44    48   268.000  1.529
   44    50   320.000  1.410
   47    55   549.000  1.340
   47    58   510.000  1.338
   55    62   320.000  1.462
   55    92   317.000  1.510
   62    63   570.000  1.229
   62    68   310.000  1.470
   68    80   469.000  1.400
   68   105   469.000  1.400
   80    84   469.000  1.400
   80    86   317.000  1.510
   84    85   367.000  1.080
   84    90   469.000  1.400
   90    91   367.000  1.080
   90   100   469.000  1.400
  100   101   367.000  1.080
  100   105   469.000  1.400
  105   106   450.000  1.364
  106   107   553.000  0.945
   86    92   268.000  1.529
   86    94   268.000  1.529
   86    98   320.000  1.410
   92    93   340.000  1.090
   92   102   268.000  1.529
  102   103   340.000  1.090
  102   104   340.000  1.090
  102    48   268.000  1.529
   48    49   340.000  1.090
   48    56   268.000  1.529
   56    57   340.000  1.090
   56    64   382.000  1.448
   64    69   382.000  1.448
   64    73   382.000  1.448
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    97   340.000  1.090
   98    99   553.000  0.945
   58    59   553.000  0.945
   50    51   553.000  0.945
   42    43   570.000  1.229
   42    45   490.000  1.335
   45    46   434.000  1.010
   45    52   337.000  1.449
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    60   367.000  1.471
   60    61   434.000  1.010
   60    65   367.000  1.471
   60    87   367.000  1.471
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    77   268.000  1.529
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    81   268.000  1.529
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    87   268.000  1.529
   87    88   340.000  1.090
   87    89   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    85.00000  114.68000
   29    33    38    75.00000  111.63000
   29    33    56    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    63.00000  111.10000
   33    38    42    63.00000  111.10000
   33    56    48    58.35000  112.70000
   33    56    57    37.50000  110.70000
   33    56    64    56.20000  109.47000
   38    33    34    50.00000  109.50000
   38    40    41    80.00000  120.40000
   38    40    44    70.00000  116.00000
   38    42    43    80.00000  120.40000
   38    42    45    70.00000  116.60000
   40    38    39    35.00000  109.50000
   40    44    47    70.00000  109.06800
   40    44    48    63.00000  111.10000
   40    44    50    90.00000  109.61100
   44    40    41    80.00000  120.40000
   44    47    55    70.00000  124.00000
   44    47    58    90.00000  109.34000
   44    48   102    58.35000  112.70000
   44    48    49    37.50000  110.70000
   44    48    56    58.35000  112.70000
   44    50    51    55.00000  108.50000
   47    55    62    65.00000  118.96000
   47    55    92    70.00000  124.00000
   47    58    59    70.00000  107.45700
   55    62    63    80.00000  123.72100
   55    62    68    65.00000  117.02400
   55    92    86    70.00000  112.02700
   55    92    93    35.00000  109.50000
   55    92   102    70.00000  112.02700
   62    68    80    60.00000  119.52600
   62    68   105    60.00000  119.52600
   68    62    63    75.00000  123.78400
   68    80    84    63.00000  120.00000
   68    80    86    70.00000  120.00000
   68   105   100    63.00000  120.00000
   68   105   106    70.00000  120.00000
   80    84    85    35.00000  120.00000
   80    84    90    63.00000  120.00000
   80    86    92    70.00000  112.17500
   80    86    94    70.00000  112.17500
   80    86    98    90.00000  112.51600
   84    90    91    35.00000  120.00000
   84    90   100    63.00000  120.00000
   90    84    85    35.00000  120.00000
   90   100   101    35.00000  120.00000
   90   100   105    63.00000  120.00000
  100    90    91    35.00000  120.00000
  100   105   106    70.00000  120.00000
  105    68    80    63.00000  120.00000
  105   100   101    35.00000  120.00000
  105   106   107    35.00000  113.00000
   86    80    84    70.00000  120.00000
   86    92    93    37.50000  110.70000
   86    92   102    58.35000  112.70000
   86    94    95    37.50000  110.70000
   86    94    96    37.50000  110.70000
   86    94    97    37.50000  110.70000
   86    98    99    55.00000  108.50000
   92    55    62    65.00000  116.34900
   92   102   103    37.50000  110.70000
   92   102   104    37.50000  110.70000
   92   102    48    58.35000  112.70000
  102    92    93    37.50000  110.70000
  102    48    49    37.50000  110.70000
  102    48    56    58.35000  112.70000
  104   102   103    33.00000  107.80000
   48    44    47    70.00000  112.02700
   48   102   103    37.50000  110.70000
   48   102   104    37.50000  110.70000
   48    56    57    37.50000  110.70000
   48    56    64    56.20000  109.47000
   56    33    34    50.00000  109.50000
   56    33    38    58.35000  112.70000
   56    48    49    37.50000  110.70000
   56    64    69    51.80000  107.20000
   56    64    73    51.80000  107.20000
   64    56    57    35.00000  109.50000
   64    69    70    35.00000  109.50000
   64    69    71    35.00000  109.50000
   64    69    72    35.00000  109.50000
   64    73    74    35.00000  109.50000
   64    73    75    35.00000  109.50000
   64    73    76    35.00000  109.50000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   73    64    69    51.80000  107.20000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   94    86    92    58.35000  112.70000
   96    94    95    33.00000  107.80000
   97    94    95    33.00000  107.80000
   97    94    96    33.00000  107.80000
   98    86    92    50.00000  109.50000
   98    86    94    50.00000  109.50000
   58    47    55    80.00000  121.38400
   50    44    47    90.00000  110.39200
   50    44    48    50.00000  109.50000
   42    38    39    35.00000  109.50000
   42    38    40    70.00000  107.85200
   42    45    46    35.00000  119.80000
   42    45    52    50.00000  121.90000
   45    42    43    80.00000  122.90000
   45    52    53    35.00000  109.50000
   45    52    54    35.00000  109.50000
   45    52    60    80.00000  116.76000
   52    45    46    38.00000  118.40000
   52    60    61    35.00000  109.50000
   52    60    65    75.00000  113.01200
   52    60    87    75.00000  113.01200
   54    52    53    33.00000  107.80000
   60    52    53    35.00000  109.50000
   60    52    54    35.00000  109.50000
   60    65    66    35.00000  109.50000
   60    65    67    35.00000  109.50000
   60    65    77    80.00000  111.20000
   60    87    81    80.00000  111.20000
   60    87    88    35.00000  109.50000
   60    87    89    35.00000  109.50000
   65    60    61    35.00000  109.50000
   65    77    78    37.50000  110.70000
   65    77    79    37.50000  110.70000
   65    77    81    58.35000  112.70000
   67    65    66    33.00000  107.80000
   77    65    66    37.50000  110.70000
   77    65    67    37.50000  110.70000
   77    81    82    37.50000  110.70000
   77    81    83    37.50000  110.70000
   77    81    87    58.35000  112.70000
   79    77    78    33.00000  107.80000
   81    77    78    37.50000  110.70000
   81    77    79    37.50000  110.70000
   81    87    88    37.50000  110.70000
   81    87    89    37.50000  110.70000
   83    81    82    33.00000  107.80000
   87    60    61    35.00000  109.50000
   87    60    65    75.00000  113.01200
   87    81    82    37.50000  110.70000
   87    81    83    37.50000  110.70000
   89    87    88    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
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   54    52    60    87   0.15000  1.0 3.0
   60    65    77    78   0.19200  1.0 3.0
   60    65    77    79   0.19200  1.0 3.0
   60    65   -77    81   1.36600  1.0 1.0
   60    65   -77    81  -0.11450 -1.0 2.0
   60    65   -77    81   0.24250  1.0 3.0
   61    60    65    66   0.13050  1.0 3.0
   61    60    65    67   0.13050  1.0 3.0
   61    60    65    77   0.17350  1.0 3.0
   61    60    87    81   0.17350  1.0 3.0
   61    60    87    88   0.13050  1.0 3.0
   61    60    87    89   0.13050  1.0 3.0
   65    60   -87    81   0.47100  1.0 1.0
   65    60    87    88   0.15000  1.0 3.0
   65    60    87    89   0.15000  1.0 3.0
   65    77    81    82   0.15000  1.0 3.0
   65    77    81    83   0.15000  1.0 3.0
   65    77   -81    87   0.56750  1.0 1.0
   65    77   -81    87  -0.07550 -1.0 2.0
   65    77   -81    87   0.20000  1.0 3.0
   66    65    77    78   0.15000  1.0 3.0
   66    65    77    79   0.15000  1.0 3.0
   66    65    77    81   0.15000  1.0 3.0
   67    65    77    78   0.15000  1.0 3.0
   67    65    77    79   0.15000  1.0 3.0
   67    65    77    81   0.15000  1.0 3.0
   77    81   -87    60   1.36600  1.0 1.0
   77    81   -87    60  -0.11450 -1.0 2.0
   77    81   -87    60   0.24250  1.0 3.0
   77    81    87    88   0.15000  1.0 3.0
   77    81    87    89   0.15000  1.0 3.0
   78    77    81    82   0.15000  1.0 3.0
   78    77    81    83   0.15000  1.0 3.0
   78    77    81    87   0.15000  1.0 3.0
   79    77    81    82   0.15000  1.0 3.0
   79    77    81    83   0.15000  1.0 3.0
   79    77    81    87   0.15000  1.0 3.0
   82    81    87    60   0.19200  1.0 3.0
   82    81    87    88   0.15000  1.0 3.0
   82    81    87    89   0.15000  1.0 3.0
   83    81    87    60   0.19200  1.0 3.0
   83    81    87    88   0.15000  1.0 3.0
   83    81    87    89   0.15000  1.0 3.0
   87    60    65    66   0.15000  1.0 3.0
   87    60    65    67   0.15000  1.0 3.0
   87    60   -65    77   0.47100  1.0 1.0
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
   36    30    35    37  10.50000 -1.0 2.0
   38    44    40    41  10.50000 -1.0 2.0
   44    58    47    55   1.10000 -1.0 2.0
   62    92    55    47   1.10000 -1.0 2.0
   55    68    62    63  10.50000 -1.0 2.0
   80   105    68    62   4.00000 -1.0 2.0
   84    86    80    68   4.00000 -1.0 2.0
   90    85    84    80   1.10000 -1.0 2.0
  100    91    90    84   1.10000 -1.0 2.0
  105   101   100    90   1.10000 -1.0 2.0
  100   106   105    68   4.00000 -1.0 2.0
   38    45    42    43  10.50000 -1.0 2.0
   46    42    45    52   1.00000 -1.0 2.0
END
