* LIGAND DATABASE FILE (OPLS2005)
*
001     100   103    201    334     616
    1     0 S   NP   _N1_     1    28.62044    94.17937   -23.99220
    2     1 S   H    _HN1     2     1.02782   105.86665   -92.89925
    3     1 S   H    _H1_     3     1.02949    86.08393    15.08560
    4     1 S   H    _H2_     4     1.02826    23.53843   168.62618
    5     1 S   CT   _CA1     5     1.50120   129.92260   128.55652
    6     5 S   HC   _HA1     6     1.09574   105.19225    75.24112
    7     5 S   CO3  _C1_     7     1.53781   112.36738   -44.97269
    8     7 S   O2Z  _O11     8     1.26374   115.00240   -44.27124
    9     7 S   O2Z  _O12     9     1.26231   114.92858   134.73198
   10     5 S   CT   _CB1    10     1.53067   107.40346  -166.82665
   11    10 S   HC   HB11    11     1.09834   109.35589   -49.83796
   12    10 S   HC   HB12    12     1.09812   110.46568    66.75572
   13    10 S   CT   _CG1    13     1.52994   112.61741  -170.81290
   14    13 S   HC   HG11    14     1.09590   110.63142   -65.63090
   15    13 S   HC   HG12    15     1.09668   109.80616    53.61342
   16    13 S   C    _CD1    16     1.51812   112.15941   174.03806
   17    16 S   O    _OE1    17     1.22738   123.27686     6.80953
   18    16 S   N    _N2_    18     1.38632   111.70784  -173.32644
   19    18 S   H    _HN2    19     1.01591   118.93171     1.52829
   20    18 S   CT1  _CA2    20     1.46239   123.38623   177.99924
   21    20 S   HC   _HA2    21     1.09736   109.40914     1.90762
   22    20 S   C    _C2_    22     1.53520   108.61885  -113.64755
   23    22 S   O    _O2_    23     1.23060   122.26758  -147.73383
   24    20 S   CT   _CB2    32     1.53465   111.44213   123.95453
   25    24 S   HC   HB21    33     1.09313   109.31782    57.38410
   26    24 S   HC   HB22    34     1.09475   109.83032   176.02561
   27    22 S   N    _N3_    24     1.38326   113.69422    39.70649
   28    27 S   H    _HN3    25     1.01593   119.58020    -3.37661
   29    24 S   S    _SG2    35     1.82983   110.92634   -64.82906
   30    27 S   CT   _CA3    26     1.45285   123.18900   177.10173
   31    30 S   HC   HA31    27     1.09550   107.51891   -64.33731
   32    30 S   HC   HA32    28     1.09558   107.96714    52.08863
   33    29 S   CT   _C20    36     1.88757   103.23215   165.19518
   34    30 S   CO3  _C3_    29     1.52954   114.10667   174.09605
   35    34 S   O2Z  _O31    30     1.26372   116.07776    -0.19383
   36    34 S   O2Z  _O32    31     1.26430   114.40765   179.85598
   37    33 S   CT   _C25    37     1.55167   107.32081   -70.74477
   38    37 S   HC   _H29    38     1.09505   111.83064   170.74209
   39    37 S   HC   _H30    39     1.09454   112.02786    52.99651
   40    33 S   CT   _C19    86     1.54861   108.55562    47.21097
   41    40 S   HC   _H23    87     1.09902   110.18379    48.92353
   42    40 S   HC   _H24    88     1.09779   110.63522   -66.65822
   43    37 S   CO4  _C24    40     1.51192   112.69251   -69.47281
   44    43 S   O    _O35    41     1.23017   121.51300   133.57453
   45    43 S   CT   _C23    42     1.50640   116.58017   -51.55821
   46    45 S   HC   _H27    43     1.09552   108.77666   171.29182
   47    45 S   HC   _H28    44     1.09406   108.78051   -71.77887
   48    45 S   CT   _C22    45     1.52111   110.11009    51.27240
   49    48 S   HC   _H25    46     1.09805   107.81999    68.73445
   50    48 S   HC   _H26    47     1.09522   109.17390  -178.42890
   51    33 S   CT   _C21    48     1.60372   109.89464   168.73177
   52    51 S   CT   _C16    49     1.58073   108.15190  -172.10653
   53    52 S   HC   _H7_    50     1.08971   105.07274   -58.45384
   54    51 S   CT   _C26    97     1.55492   112.65619   -50.92402
   55    54 S   HC   _H31    98     1.09281   112.79741   -50.63348
   56    54 S   HC   _H32    99     1.09491   111.25071  -171.74745
   57    54 S   HC   _H33   100     1.09533   112.02754    70.02141
   58    52 S   CT   _C15    51     1.54192   117.09585  -174.01719
   59    58 S   HC   _H21    52     1.09695   108.98089   -72.95321
   60    58 S   HC   _H22    53     1.09284   111.25179    44.83194
   61    58 S   CT   _C14    54     1.55162   112.34595   166.79220
   62    61 S   HC   _H6_    55     1.09024   106.11014   154.51979
   63    61 S   CT   _C13    56     1.55786   113.94780    31.16250
   64    61 S   OH   _O37    95     1.42899   109.14495   -92.71482
   65    64 S   HO   _H35    96     0.97241   107.65213   -59.90478
   66    63 S   CT   _C12    57     1.54591   109.17849    27.42461
   67    66 S   HC   _H5_    58     1.09978   106.67747    56.34690
   68    63 S   CT   _C27    91     1.56418   111.14132   -96.68504
   69    68 S   HC   _H36    92     1.09686   110.64786   -63.42712
   70    68 S   HC   _H37    93     1.09471   112.44433   178.26991
   71    68 S   HC   _H38    94     1.08929   113.87572    56.94180
   72    66 S   CT   _C11    59     1.52187   104.16712   166.69574
   73    72 S   HC   _H19    60     1.09489   112.07258  -158.81486
   74    72 S   HC   _H20    61     1.09442   112.41637    79.66610
   75    52 S   CT   _C17    82     1.55886   111.85056    58.47218
   76    75 S   HC   _H8_    83     1.09912   108.30774    53.46114
   77    72 S   CT   _C10    62     1.53245   103.99059   -38.87432
   78    77 S   HC   _H17    63     1.09621   110.03722   140.42143
   79    77 S   HC   _H18    64     1.09354   109.63210  -102.79569
   80    75 S   CT   _C18    84     1.53262   109.99572   -60.90088
   81    80 S   HC   _H9_    85     1.09482   110.30485   -68.02342
   82    63 S   CT   _C9_    65     1.57858   117.15008   142.31322
   83    82 S   HC   _H4_    66     1.10008   107.17063    98.83044
   84    80 S   OH   _O36    89     1.42730   110.01535   173.51176
   85    84 S   HO   _H34    90     0.97243   107.68529   177.27983
   86    82 S   CT   _C5_    67     1.56198   119.97735   -19.59680
   87    86 S   HC   _H3_    68     1.09765   107.03879    55.98034
   88    86 S   CT   _C4_    69     1.54076   109.53909   170.03342
   89    88 S   HC   _H10    70     1.09451   111.75336    72.70039
   90    88 S   HC   _H11    71     1.09538   111.03291   -48.04381
   91    88 S   HC   _H12    72     1.09444   111.15984  -166.62896
   92    86 S   CT   _C6_    73     1.54635   115.26709   -64.45928
   93    92 S   HC   _H13    74     1.09592   110.44985   -64.41201
   94    92 S   HC   _H14    75     1.09260   109.95569    52.67559
   95    92 S   CT   _C7_    76     1.53025   113.48019   173.22240
   96    95 S   HC   _H15    77     1.09698   109.41431   -50.59011
   97    95 S   HC   _H16    78     1.09583   110.14753    67.57817
   98    95 S   CO3  _C8_    79     1.53346   115.00515  -171.80849
   99    98 S   O2Z  _O34    80     1.26528   114.02559   172.18837
  100    98 S   O2Z  _O33    81     1.26138   116.68472    -8.08422
  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  13   5   4   3
  24   2   1   1  15   6   5  14   6   5   8   4   8   5   4  11
   4   3  14  20   9   5   2   1   1  13   6   5  16   6  23   4
   1  19   9   9   3   2   1  11   6   5   7   3   8   4   3   3
   2  11   4   1   1  12   8   7   3   2   1   8   5   4   5   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    51    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    43    48    51    52    80    40    41    42    54  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    43    44    45    48    49    50    51    52    53    58    75    80    81    40    41    42    84    54    55    56    57  
   35    36  
   36  
    0  
   38    39    43    44    45    46    47    48    51    52    80    40    41    42    54  
   39    43    44    45    51    40  
   43    44    45    51    40  
   41    42    84    85    54    43    48    51    52    66    75    76    80    81  
   42    84    51    75    80    81  
   84    51    75    80    81  
   44    45    46    47    48    49    50    51  
   45    46    47    48  
   46    47    48    49    50    51    52    54  
   47    48    49    50    51  
   48    49    50    51  
   49    50    51    52    53    58    75    54    55    56    57  
   50    51    52    54  
   51    52    54  
   52    53    58    59    60    61    66    75    76    80    54    55    56    57  
   53    58    59    60    61    62    63    66    67    72    75    76    80    81    84    64    54    55    56    57  
   58    59    60    61    66    75    76    80    54  
   55    56    57    58    75  
   56    57  
   57  
    0  
   59    60    61    62    63    66    82    75    76    80    68    64    65  
   60    61    62    63    75    64  
   61    62    63    75    64  
   62    63    66    67    72    77    82    83    86    75    68    69    70    71    64    65  
   63    66    82    68    64    65  
   66    67    72    73    74    77    78    79    82    83    86    87    88    92    75    76    80    68    69    70    71    64    65  
   65    66    68    82  
    0  
   67    72    73    74    77    78    79    82    83    86    75    76    80    81    84    68    69    70    71  
   72    73    74    77    82    75    76    80    68  
   69    70    71    72    75    77    82    83    86  
   70    71    82  
   71    82  
   82  
   73    74    77    78    79    82    83    86    75    76    80  
   74    77    78    79    82    75  
   77    78    79    82    75  
   76    80    81    84    85    77    82  
   80    81    84  
   78    79    82    83    86    87    88    92  
   79    82    83    86  
   82    83    86  
   81    84    85  
   84    85  
   83    86    87    88    89    90    91    92    93    94    95  
   86    87    88    92  
   85  
    0  
   87    88    89    90    91    92    93    94    95    96    97    98  
   88    89    90    91    92    93    94    95  
   89    90    91    92    93    94    95  
   90    91    92  
   91    92  
   92  
   93    94    95    96    97    98    99   100  
   94    95    96    97    98  
   95    96    97    98  
   96    97    98    99   100  
   97    98    99   100  
   98    99   100  
   99   100  
  100  
    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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   52   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   64   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   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   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   85   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   98   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   99   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  100   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
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   268.000  1.529
   33    51   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    43   317.000  1.522
   43    44   570.000  1.229
   43    45   317.000  1.522
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   268.000  1.529
   51    52   268.000  1.529
   51    54   268.000  1.529
   52    53   340.000  1.090
   52    58   268.000  1.529
   52    75   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   268.000  1.529
   61    62   340.000  1.090
   61    63   268.000  1.529
   61    64   320.000  1.410
   63    66   268.000  1.529
   63    82   268.000  1.529
   63    68   268.000  1.529
   66    67   340.000  1.090
   66    72   268.000  1.529
   66    75   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    77   268.000  1.529
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    82   268.000  1.529
   82    83   340.000  1.090
   82    86   268.000  1.529
   86    87   340.000  1.090
   86    88   268.000  1.529
   86    92   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    91   340.000  1.090
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   268.000  1.529
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   317.000  1.522
   98    99   656.000  1.250
   98   100   656.000  1.250
   75    76   340.000  1.090
   75    80   268.000  1.529
   80    81   340.000  1.090
   80    40   268.000  1.529
   80    84   320.000  1.410
   40    41   340.000  1.090
   40    42   340.000  1.090
   84    85   553.000  0.945
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   64    65   553.000  0.945
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   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  111.63000
   29    33    51    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    43    63.00000  111.10000
   33    51    48    58.35000  112.70000
   33    51    52    58.35000  112.70000
   33    51    54    58.35000  112.70000
   33    40    80    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   37    43    44    80.00000  120.40000
   37    43    45    70.00000  116.00000
   39    37    38    33.00000  107.80000
   43    37    38    35.00000  109.50000
   43    37    39    35.00000  109.50000
   43    45    46    35.00000  109.50000
   43    45    47    35.00000  109.50000
   43    45    48    63.00000  111.10000
   45    43    44    80.00000  120.40000
   45    48    49    37.50000  110.70000
   45    48    50    37.50000  110.70000
   45    48    51    58.35000  112.70000
   47    45    46    33.00000  107.80000
   48    45    46    37.50000  110.70000
   48    45    47    37.50000  110.70000
   48    51    52    58.35000  112.70000
   48    51    54    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    33    37    58.35000  112.70000
   51    48    49    37.50000  110.70000
   51    48    50    37.50000  110.70000
   51    52    53    37.50000  110.70000
   51    52    58    58.35000  112.70000
   51    52    75    58.35000  112.70000
   51    54    55    37.50000  110.70000
   51    54    56    37.50000  110.70000
   51    54    57    37.50000  110.70000
   52    58    59    37.50000  110.70000
   52    58    60    37.50000  110.70000
   52    58    61    58.35000  112.70000
   52    75    66    58.35000  112.70000
   52    75    76    37.50000  110.70000
   52    75    80    58.35000  112.70000
   58    52    53    37.50000  110.70000
   58    61    62    37.50000  110.70000
   58    61    63    58.35000  112.70000
   58    61    64    50.00000  109.50000
   60    58    59    33.00000  107.80000
   61    58    59    37.50000  110.70000
   61    58    60    37.50000  110.70000
   61    63    66    58.35000  112.70000
   61    63    82    58.35000  112.70000
   61    63    68    58.35000  112.70000
   61    64    65    55.00000  108.50000
   63    61    62    37.50000  110.70000
   63    66    67    37.50000  110.70000
   63    66    72    58.35000  112.70000
   63    66    75    58.35000  112.70000
   63    82    77    58.35000  112.70000
   63    82    83    37.50000  110.70000
   63    82    86    58.35000  112.70000
   63    68    69    37.50000  110.70000
   63    68    70    37.50000  110.70000
   63    68    71    37.50000  110.70000
   66    72    73    37.50000  110.70000
   66    72    74    37.50000  110.70000
   66    72    77    58.35000  112.70000
   66    75    76    37.50000  110.70000
   66    75    80    58.35000  112.70000
   72    66    67    37.50000  110.70000
   72    77    78    37.50000  110.70000
   72    77    79    37.50000  110.70000
   72    77    82    58.35000  112.70000
   74    72    73    33.00000  107.80000
   77    72    73    37.50000  110.70000
   77    72    74    37.50000  110.70000
   77    82    83    37.50000  110.70000
   77    82    86    58.35000  112.70000
   79    77    78    33.00000  107.80000
   82    63    66    58.35000  112.70000
   82    77    78    37.50000  110.70000
   82    77    79    37.50000  110.70000
   82    86    87    37.50000  110.70000
   82    86    88    58.35000  112.70000
   82    86    92    58.35000  112.70000
   86    82    83    37.50000  110.70000
   86    88    89    37.50000  110.70000
   86    88    90    37.50000  110.70000
   86    88    91    37.50000  110.70000
   86    92    93    37.50000  110.70000
   86    92    94    37.50000  110.70000
   86    92    95    58.35000  112.70000
   88    86    87    37.50000  110.70000
   90    88    89    33.00000  107.80000
   91    88    89    33.00000  107.80000
   91    88    90    33.00000  107.80000
   92    86    87    37.50000  110.70000
   92    86    88    58.35000  112.70000
   92    95    96    37.50000  110.70000
   92    95    97    37.50000  110.70000
   92    95    98    70.00000  109.69300
   94    92    93    33.00000  107.80000
   95    92    93    37.50000  110.70000
   95    92    94    37.50000  110.70000
   95    98    99    70.00000  117.00000
   95    98   100    70.00000  117.00000
   97    95    96    33.00000  107.80000
   98    95    96    35.00000  109.50000
   98    95    97    35.00000  109.50000
  100    98    99    80.00000  126.00000
   75    52    53    37.50000  110.70000
   75    52    58    58.35000  112.70000
   75    66    67    37.50000  110.70000
   75    66    72    58.35000  112.70000
   75    80    81    37.50000  110.70000
   75    80    40    58.35000  112.70000
   75    80    84    50.00000  109.50000
   80    75    76    37.50000  110.70000
   80    40    41    37.50000  110.70000
   80    40    42    37.50000  110.70000
   80    84    85    55.00000  108.50000
   40    33    37    58.35000  112.70000
   40    33    51    58.35000  112.70000
   40    80    81    37.50000  110.70000
   42    40    41    33.00000  107.80000
   84    80    81    35.00000  109.50000
   84    80    40    50.00000  109.50000
   68    63    66    58.35000  112.70000
   68    63    82    58.35000  112.70000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   64    61    62    35.00000  109.50000
   64    61    63    50.00000  109.50000
   54    51    52    58.35000  112.70000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    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
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
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   40    33    37    43  -0.18200 -1.0 2.0
   40    33    37    43   0.29450  1.0 3.0
   40    33    51    48   0.56750  1.0 1.0
   40    33    51    48  -0.07550 -1.0 2.0
   40    33    51    48   0.20000  1.0 3.0
   40    33   -51    52   0.56750  1.0 1.0
   40    33   -51    52  -0.07550 -1.0 2.0
   40    33   -51    52   0.20000  1.0 3.0
   40    33    51    54   0.56750  1.0 1.0
   40    33    51    54  -0.07550 -1.0 2.0
   40    33    51    54   0.20000  1.0 3.0
   40    80    84    85  -0.11600  1.0 1.0
   40    80    84    85  -0.09450 -1.0 2.0
   40    80    84    85   0.21250  1.0 3.0
   84    80    40    33   0.86500  1.0 1.0
   84    80    40    33  -0.17500 -1.0 2.0
   84    80    40    33   0.20800  1.0 3.0
   84    80    40    41   0.23400  1.0 3.0
   84    80    40    42   0.23400  1.0 3.0
   68    63    66    67   0.15000  1.0 3.0
   68    63    66    72   0.56750  1.0 1.0
   68    63    66    72  -0.07550 -1.0 2.0
   68    63    66    72   0.20000  1.0 3.0
   68    63    66    75   0.56750  1.0 1.0
   68    63    66    75  -0.07550 -1.0 2.0
   68    63    66    75   0.20000  1.0 3.0
   68    63    82    77   0.56750  1.0 1.0
   68    63    82    77  -0.07550 -1.0 2.0
   68    63    82    77   0.20000  1.0 3.0
   68    63    82    83   0.15000  1.0 3.0
   68    63    82    86   0.56750  1.0 1.0
   68    63    82    86  -0.07550 -1.0 2.0
   68    63    82    86   0.20000  1.0 3.0
   64    61    63    66   0.86500  1.0 1.0
   64    61    63    66  -0.17500 -1.0 2.0
   64    61    63    66   0.20800  1.0 3.0
   64    61    63    82   0.86500  1.0 1.0
   64    61    63    82  -0.17500 -1.0 2.0
   64    61    63    82   0.20800  1.0 3.0
   64    61    63    68   0.86500  1.0 1.0
   64    61    63    68  -0.17500 -1.0 2.0
   64    61    63    68   0.20800  1.0 3.0
   54    51    52    53   0.15000  1.0 3.0
   54    51    52    58   0.56750  1.0 1.0
   54    51    52    58  -0.07550 -1.0 2.0
   54    51    52    58   0.20000  1.0 3.0
   54    51    52    75   0.56750  1.0 1.0
   54    51    52    75  -0.07550 -1.0 2.0
   54    51    52    75   0.20000  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
   37    45    43    44  10.50000 -1.0 2.0
   99    95    98   100  10.50000 -1.0 2.0
END
