* LIGAND DATABASE FILE (OPLS2005)
*
001      99   102    191    309     574
    1     0 S   NP   _N1_     1    28.61304    93.59227   -22.99639
    2     1 S   H    _HN1     2     1.02778   100.44286   -76.51019
    3     1 S   H    _H1_     3     1.02961    90.49672    32.22770
    4     1 S   H    _H2_     4     1.02835    22.15253   171.39040
    5     1 S   CT   _CA1     5     1.50118   131.79016   150.57745
    6     5 S   HC   _HA1     6     1.09577   105.23569    67.37370
    7     5 S   CO3  _C1_     7     1.53788   112.37039   -52.81419
    8     7 S   O2Z  _O11     8     1.26355   115.01042   -44.49720
    9     7 S   O2Z  _O12     9     1.26242   114.91329   134.67352
   10     5 S   CT   _CB1    10     1.53094   107.41640  -174.76378
   11    10 S   HC   HB11    11     1.09823   109.30679   -51.22671
   12    10 S   HC   HB12    12     1.09820   110.42358    65.30764
   13    10 S   CT   _CG1    13     1.53002   112.68073  -172.36336
   14    13 S   HC   HG11    14     1.09600   110.39417   -63.66181
   15    13 S   HC   HG12    15     1.09649   110.02740    55.54962
   16    13 S   C    _CD1    16     1.51815   112.32430   175.85235
   17    16 S   O    _OE1    17     1.22723   123.27252    -4.11775
   18    16 S   N    _N2_    18     1.38637   111.62612   176.20109
   19    18 S   H    _HN2    19     1.01583   119.02890     1.09056
   20    18 S   CT1  _CA2    20     1.46167   123.36440  -179.78878
   21    20 S   HC   _HA2    21     1.09744   109.37862    -9.15551
   22    20 S   C    _C2_    22     1.53468   108.42019  -124.67807
   23    22 S   O    _O2_    23     1.23024   122.22053  -145.99323
   24    20 S   CT   _CB2    32     1.53567   111.66138   112.83889
   25    24 S   HC   HB21    33     1.09557   109.44505    54.79426
   26    24 S   HC   HB22    34     1.08959   109.69354   172.88087
   27    22 S   N    _N3_    24     1.38496   113.41440    41.41891
   28    27 S   H    _HN3    25     1.01517   118.92248    -0.65042
   29    24 S   S    _SG2    35     1.82938   111.37162   -64.99348
   30    27 S   CT   _CA3    26     1.45446   123.45995   174.93693
   31    30 S   HC   HA31    27     1.09521   109.25689    24.23598
   32    30 S   HC   HA32    28     1.09495   107.12634   141.25927
   33    29 S   CT   _C15    36     1.89595   104.28074  -153.38811
   34    30 S   CO3  _C3_    29     1.52926   113.06626   -99.23879
   35    34 S   O2Z  _O31    30     1.26406   115.39011   -44.63134
   36    34 S   O2Z  _O32    31     1.26353   114.98982   136.27454
   37    33 S   CT   _C16    37     1.60758   111.12250   -39.68206
   38    37 S   HC   _H6_    38     1.09239   110.20555     0.10279
   39    33 S   CT   _C14    71     1.60458   104.21643  -155.97629
   40    39 S   HC   _H5_    72     1.09716   107.77330  -167.93791
   41    37 S   CT   _C17    39     1.53703   113.93245   117.32368
   42    41 S   HC   _H16    40     1.09320   109.19414   -73.72124
   43    41 S   HC   _H17    41     1.09627   111.11137   173.25608
   44    37 S   CT   _C11    59     1.54628   111.67047  -116.87166
   45    44 S   HC   _H4_    60     1.10043   106.95209   -62.06654
   46    39 S   OH   _O37    73     1.43268   112.90520   -52.28788
   47    46 S   HO   _H26    74     0.97240   107.82350  -173.79616
   48    41 S   CT   _C18    42     1.52327   114.02243    50.02607
   49    48 S   HC   _H18    43     1.09703   108.53743  -161.10341
   50    48 S   HC   _H19    44     1.09784   108.46949    83.21457
   51    44 S   CT   _C10    61     1.53271   118.32856  -179.59074
   52    51 S   HC   _H12    62     1.09613   110.63176   -37.61007
   53    51 S   HC   _H13    63     1.09510   111.36589    82.28715
   54    48 S   CM   _C19    45     1.50744   114.08983   -38.99397
   55    51 S   CT   _C9_    64     1.54240   105.01890  -155.93849
   56    55 S   HC   _H3_    65     1.09749   108.86492   120.79664
   57    54 S   CM   _C20    46     1.34379   118.67482   161.73588
   58    57 S   HC   _H20    47     1.08510   121.72015     0.75017
   59    55 S   CT   _C8_    66     1.55830   106.16577     1.20756
   60    55 S   OS   _O38    93     1.43832   111.79171  -118.63187
   61    57 S   CO4  _C21    48     1.47658   121.86206  -179.65338
   62    61 S   O    _O36    49     1.22596   121.16464   179.49993
   63    44 S   CT   _C12    67     1.54963   113.07852    58.29360
   64    59 S   CO4  _C7_    79     1.53839   112.18371   152.15942
   65    64 S   O    _O35    80     1.23278   121.47582    -3.26003
   66    59 S   OH   _O40    91     1.42827   109.45431   -89.52716
   67    66 S   HO   _H33    92     0.97379   107.45111   -47.64605
   68    60 S   CO4  _C27    94     1.36331   116.67922   -76.83114
   69    68 S   O    _O39    95     1.22314   126.36048     0.63242
   70    61 S   CM   _C22    50     1.47287   117.63487    -0.68128
   71    70 S   HC   _H21    51     1.08344   117.99475  -178.89147
   72    63 S   CT   _C13    68     1.53751   108.33530   -62.35979
   73    72 S   HC   _H14    69     1.09698   110.86297  -111.25884
   74    72 S   HC   _H15    70     1.09838   110.80003   134.50428
   75    63 S   CT   _C26    75     1.55188   113.37117    58.53506
   76    75 S   HC   _H27    76     1.09372   113.00659    54.93050
   77    75 S   HC   _H28    77     1.09173   112.21328   -65.99437
   78    75 S   HC   _H29    78     1.09561   110.94461   175.33881
   79    64 S   CT   _C6_    81     1.52066   117.54377   176.54538
   80    79 S   HC   _H10    82     1.09301   108.99320    67.62178
   81    79 S   HC   _H11    83     1.09403   109.20810   -54.33640
   82    68 S   CT   _C28    96     1.49827   109.50237  -179.58363
   83    82 S   HC   _H30    97     1.09288   109.81450   -61.54654
   84    82 S   HC   _H31    98     1.09378   109.36396   179.36789
   85    82 S   HC   _H32    99     1.09292   109.83310    60.35573
   86    70 S   CM   _C23    52     1.33738   120.40520     1.45212
   87    86 S   HC   _H22    53     1.08902   117.33197  -179.87489
   88    79 S   OS   _O34    84     1.43002   108.84681  -173.56480
   89    33 S   CT   _C24    54     1.62758   110.23207    86.09866
   90    88 S   CO4  _C5_    85     1.36262   115.21116   179.68225
   91    90 S   O    _O33    86     1.22337   126.18889    -0.28736
   92    89 S   CT   _C25    55     1.55323   116.69013   -46.84849
   93    92 S   HC   _H23    56     1.08833   114.56828   -58.08307
   94    92 S   HC   _H24    57     1.09965   110.73514  -177.07591
   95    92 S   HC   _H25    58     1.09616   112.35858    64.62283
   96    90 S   CT   _C4_    87     1.49832   109.63143   179.76015
   97    96 S   HC   _H7_    88     1.09290   109.83479   -60.84197
   98    96 S   HC   _H8_    89     1.09380   109.35700  -179.87333
   99    96 S   HC   _H9_    90     1.09289   109.83417    61.07512
  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
  27   2   1   1  24  10  15   7  12   6   5  20   8   6   1   9
   4   3  12   6   5  12  14   6   8   4  18   9   6   3  12  10
   5   4   1   5   4   5   3   7   2   1   3   2   1   1   6   3
   2   3   2   1   1   6   2   6   4   5   4   3   2   1   1   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    89    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    54    86    89    92    44    72    39    40    46  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    43    48    54    57    70    86    87    89    92    93    94    95    44    45    51    63    72    73    74    39    40    46    47  
   35    36  
   36  
    0  
   38    41    42    43    48    49    50    54    86    89    92    44    45    51    52    53    55    59    63    72    39    40    46    75  
   41    42    43    48    89    44    45    51    63    39  
   40    46    47    75    41    44    54    59    63    72    73    74    86    89    92  
   46    47    63    72    73    74    89  
   42    43    48    49    50    54    57    89    44    45    51    63  
   43    48    49    50    54    44  
   48    49    50    54    44  
   45    51    52    53    55    56    59    63    72    73    74    75    76    77    78    64    66    60    48    89  
   51    52    53    55    59    63    72    75  
   47    63    72    73    74    89  
   72  
   49    50    54    57    58    61    86    89    92  
   50    54    57    89  
   54    57    89  
   52    53    55    56    59    63    72    75    64    66    60    68  
   53    55    56    59    63    60  
   55    56    59    63    60  
   57    58    61    62    70    86    87    89    92    93    94    95  
   56    59    63    72    75    64    65    79    66    67    60    68    69    82  
   59    63    64    66    60    68  
   58    61    62    70    71    86    89    92  
   61    62    70    89  
   63    72    73    74    75    76    77    78    64    65    79    80    81    88    66    67    60    68  
   68    69    82    83    84    85    63    64    66  
   62    70    71    86    87    89  
   70    71    86  
   72    73    74    75    76    77    78    64    65    79    66    67  
   65    79    80    81    88    90    66    67    72    75  
   79    80    81    88    66  
   67    72    75    79  
    0  
   69    82    83    84    85  
   82    83    84    85  
   71    86    87    89    92  
   86    87    89  
   73    74    75    76    77    78    89  
   74    75  
   75  
   76    77    78  
   77    78  
   78  
    0  
   80    81    88    90    91    96  
   81    88    90  
   88    90  
   83    84    85  
   84    85  
   85  
    0  
   87    89    92    93    94    95  
   89    92  
   90    91    96    97    98    99  
   92    93    94    95  
   91    96    97    98    99  
   96    97    98    99  
   93    94    95  
   94    95  
   95  
    0  
   97    98    99  
   98    99  
   99  
    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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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  -0.120000   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   57   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   60   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   61   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   63   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   64   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   66   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   67   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   68   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   70   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   71   2.4200   0.0300   0.115000   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660   0.238000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   81   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   82   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   84   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   85   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   86   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   87   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   88   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   89   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   90   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   91   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   92   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   98   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   99   2.4200   0.0150   0.060000   1.3810   1.2100   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   268.000  1.529
   33    89   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    41   268.000  1.529
   37    44   268.000  1.529
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    48   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    54   317.000  1.510
   54    57   549.000  1.340
   54    89   317.000  1.510
   57    58   340.000  1.080
   57    61   320.000  1.462
   61    62   570.000  1.229
   61    70   320.000  1.462
   70    71   340.000  1.080
   70    86   549.000  1.340
   86    87   340.000  1.080
   86    89   317.000  1.510
   89    92   268.000  1.529
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
   44    45   340.000  1.090
   44    51   268.000  1.529
   44    63   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    55   268.000  1.529
   55    56   340.000  1.090
   55    59   268.000  1.529
   55    60   320.000  1.410
   59    63   268.000  1.529
   59    64   317.000  1.522
   59    66   320.000  1.410
   63    72   268.000  1.529
   63    75   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    39   268.000  1.529
   39    40   340.000  1.090
   39    46   320.000  1.410
   46    47   553.000  0.945
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    78   340.000  1.090
   64    65   570.000  1.229
   64    79   317.000  1.522
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    88   320.000  1.410
   88    90   214.000  1.327
   90    91   570.000  1.229
   90    96   317.000  1.522
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   340.000  1.090
   66    67   553.000  0.945
   60    68   214.000  1.327
   68    69   570.000  1.229
   68    82   317.000  1.522
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   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    89    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    41    58.35000  112.70000
   33    37    44    58.35000  112.70000
   33    89    54    70.00000  112.02700
   33    89    86    70.00000  112.02700
   33    89    92    58.35000  112.70000
   33    39    72    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    46    50.00000  109.50000
   37    41    42    37.50000  110.70000
   37    41    43    37.50000  110.70000
   37    41    48    58.35000  112.70000
   37    44    45    37.50000  110.70000
   37    44    51    58.35000  112.70000
   37    44    63    58.35000  112.70000
   41    37    38    37.50000  110.70000
   41    48    49    37.50000  110.70000
   41    48    50    37.50000  110.70000
   41    48    54    70.00000  112.02700
   43    41    42    33.00000  107.80000
   48    41    42    37.50000  110.70000
   48    41    43    37.50000  110.70000
   48    54    57    70.00000  124.00000
   48    54    89    65.00000  117.92700
   50    48    49    33.00000  107.80000
   54    48    49    35.00000  109.50000
   54    48    50    35.00000  109.50000
   54    57    58    35.00000  120.00000
   54    57    61    65.00000  118.96000
   54    89    86    70.00000  110.12100
   54    89    92    70.00000  112.02700
   57    61    62    80.00000  123.72100
   57    61    70    65.00000  118.65900
   61    57    58    40.00000  117.72500
   61    70    71    40.00000  117.72500
   61    70    86    65.00000  118.96000
   70    61    62    80.00000  123.72100
   70    86    87    35.00000  120.00000
   70    86    89    70.00000  124.00000
   86    70    71    35.00000  120.00000
   86    89    92    70.00000  112.02700
   89    33    37    58.35000  112.70000
   89    54    57    70.00000  124.00000
   89    86    87    35.00000  117.00000
   89    92    93    37.50000  110.70000
   89    92    94    37.50000  110.70000
   89    92    95    37.50000  110.70000
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
   44    37    38    37.50000  110.70000
   44    37    41    58.35000  112.70000
   44    51    52    37.50000  110.70000
   44    51    53    37.50000  110.70000
   44    51    55    58.35000  112.70000
   44    63    59    58.35000  112.70000
   44    63    72    58.35000  112.70000
   44    63    75    58.35000  112.70000
   51    44    45    37.50000  110.70000
   51    55    56    37.50000  110.70000
   51    55    59    58.35000  112.70000
   51    55    60    50.00000  109.50000
   53    51    52    33.00000  107.80000
   55    51    52    37.50000  110.70000
   55    51    53    37.50000  110.70000
   55    59    63    58.35000  112.70000
   55    59    64    63.00000  111.10000
   55    59    66    50.00000  109.50000
   55    60    68    83.00000  116.90000
   59    55    56    37.50000  110.70000
   59    63    72    58.35000  112.70000
   59    63    75    58.35000  112.70000
   59    64    65    80.00000  120.40000
   59    64    79    70.00000  116.00000
   59    66    67    55.00000  108.50000
   63    44    45    37.50000  110.70000
   63    44    51    58.35000  112.70000
   63    72    73    37.50000  110.70000
   63    72    74    37.50000  110.70000
   63    72    39    58.35000  112.70000
   63    75    76    37.50000  110.70000
   63    75    77    37.50000  110.70000
   63    75    78    37.50000  110.70000
   72    39    40    37.50000  110.70000
   72    39    46    50.00000  109.50000
   74    72    73    33.00000  107.80000
   39    33    37    58.35000  112.70000
   39    33    89    58.35000  112.70000
   39    72    73    37.50000  110.70000
   39    72    74    37.50000  110.70000
   39    46    47    55.00000  108.50000
   46    39    40    35.00000  109.50000
   75    63    72    58.35000  112.70000
   77    75    76    33.00000  107.80000
   78    75    76    33.00000  107.80000
   78    75    77    33.00000  107.80000
   64    59    63    63.00000  111.10000
   64    79    80    35.00000  109.50000
   64    79    81    35.00000  109.50000
   64    79    88    90.00000  108.74100
   79    64    65    80.00000  120.40000
   79    88    90    83.00000  116.90000
   81    79    80    33.00000  107.80000
   88    79    80    35.00000  109.50000
   88    79    81    35.00000  109.50000
   88    90    91    83.00000  123.40000
   88    90    96    81.00000  111.40000
   90    96    97    35.00000  109.50000
   90    96    98    35.00000  109.50000
   90    96    99    35.00000  109.50000
   96    90    91    80.00000  120.40000
   98    96    97    33.00000  107.80000
   99    96    97    33.00000  107.80000
   99    96    98    33.00000  107.80000
   66    59    63    50.00000  109.50000
   66    59    64    90.00000  109.61100
   60    55    56    35.00000  109.50000
   60    55    59    50.00000  109.50000
   60    68    69    83.00000  123.40000
   60    68    82    81.00000  111.40000
   68    82    83    35.00000  109.50000
   68    82    84    35.00000  109.50000
   68    82    85    35.00000  109.50000
   82    68    69    80.00000  120.40000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    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
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    89   0.01700  1.0 1.0
   24    29    33    89  -0.23550 -1.0 2.0
   24    29    33    89   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    41   0.44750  1.0 1.0
   29    33    37    41  -0.17800 -1.0 2.0
   29    33    37    41   0.20200  1.0 3.0
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   60    68    82    83   0.00000  1.0 1.0
   60    68    82    84   0.00000  1.0 1.0
   60    68    82    85   0.00000  1.0 1.0
   69    68    82    83   0.00000  1.0 1.0
   69    68    82    84   0.00000  1.0 1.0
   69    68    82    85   0.00000  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
   35    30    34    36  10.50000 -1.0 2.0
   48    89    54    57   1.10000 -1.0 2.0
   61    58    57    54   1.10000 -1.0 2.0
   57    70    61    62  10.50000 -1.0 2.0
   61    71    70    86   1.10000 -1.0 2.0
   89    87    86    70   1.10000 -1.0 2.0
   59    79    64    65  10.50000 -1.0 2.0
   88    96    90    91  10.50000 -1.0 2.0
   60    82    68    69  10.50000 -1.0 2.0
END
