* LIGAND DATABASE FILE (OPLS2005)
*
001     112   113    208    313     616
    1     0 S   NP   _N1_     1    28.59067    97.28632   -23.02492
    2     1 S   H    _HN1     2     1.02783   100.99906   -80.62327
    3     1 S   H    _H1_     3     1.02952    66.77173    24.80447
    4     1 S   H    _H2_     4     1.02828    45.57985   175.02000
    5     1 S   CT   _CA1     5     1.50124   145.06246   117.51690
    6     5 S   HC   _HA1     6     1.09574   105.18032    99.30753
    7     5 S   CO3  _C1_     7     1.53785   112.48345   -20.88649
    8     7 S   O2Z  _O11     8     1.26371   115.00139   -41.64414
    9     7 S   O2Z  _O12     9     1.26242   114.94958   137.44907
   10     5 S   CT   _CB1    10     1.53077   107.41056  -142.72111
   11    10 S   HC   HB11    11     1.09833   109.33728   -49.70351
   12    10 S   HC   HB12    12     1.09813   110.45453    66.89667
   13    10 S   CT   _CG1    13     1.52991   112.62799  -170.69319
   14    13 S   HC   HG11    14     1.09581   110.62023   -66.27276
   15    13 S   HC   HG12    15     1.09672   109.78962    52.96112
   16    13 S   C    _CD1    16     1.51806   112.22882   173.38061
   17    16 S   O    _OE1    17     1.22733   123.27404     7.01739
   18    16 S   N    _N2_    18     1.38658   111.65836  -173.05666
   19    18 S   H    _HN2    19     1.01576   118.95244     1.32795
   20    18 S   CT1  _CA2    20     1.46185   123.36378   177.22752
   21    20 S   HC   _HA2    21     1.09749   109.38691     1.01895
   22    20 S   C    _C2_    22     1.53534   108.43637  -114.40994
   23    22 S   O    _O2_    23     1.23049   122.34374  -147.15855
   24    20 S   CT   _CB2    32     1.53350   111.72661   123.05897
   25    24 S   HC   HB21    33     1.09570   110.27292    56.52646
   26    24 S   HC   HB22    34     1.09362   109.59384   175.51826
   27    22 S   N    _N3_    24     1.38353   113.62917    40.17676
   28    27 S   H    _HN3    25     1.01591   119.55866    -3.20534
   29    24 S   S    _SG2    35     1.82713   111.33898   -64.30424
   30    27 S   CT   _CA3    26     1.45282   123.20749   177.17111
   31    30 S   HC   HA31    27     1.09549   107.48728   -65.10841
   32    30 S   HC   HA32    28     1.09557   108.00770    51.32636
   33    29 S   CT   _C13    36     1.85104   100.30558   178.03616
   34    33 S   HC   _H4_    37     1.09901   103.68280   -47.09983
   35    30 S   CO3  _C3_    29     1.52958   114.09585   173.34006
   36    35 S   O2Z  _O31    30     1.26375   116.08604    -0.80963
   37    35 S   O2Z  _O32    31     1.26434   114.40980   179.26618
   38    33 S   CT   _C12    38     1.55555   113.05070    66.89375
   39    38 S   HC   _H17    39     1.09850   107.46920   -69.01012
   40    38 S   HC   _H18    40     1.09633   107.86700   178.50905
   41    33 S   CT   _C14    69     1.58138   111.36569  -159.54801
   42    38 S   CT   _C11    41     1.54386   118.43010    53.83033
   43    42 S   HC   _H3_    42     1.08196   108.37935    38.90449
   44    41 S   CT   _C30    70     1.53716   111.14438   176.32640
   45    44 S   HC   _H41    71     1.09613   110.77265   -46.98666
   46    44 S   HC   _H42    72     1.09587   111.26868  -164.37692
   47    44 S   HC   _H43    73     1.09430   112.01281    74.35982
   48    41 S   OH   _O38    74     1.44090   107.39198    60.79349
   49    48 S   HO   _H44    75     0.97229   108.20943    58.55138
   50    42 S   OS   _O35    43     1.45317   110.04034   -80.61752
   51    42 S   CM   _C9_    96     1.52789   110.98446   159.48144
   52    50 S   CO4  _C25    44     1.36243   124.82974   145.75033
   53    52 S   O    _O34    45     1.22782   120.31933   171.29275
   54    51 S   CM   _C8_    97     1.35061   119.19592  -115.99185
   55    54 S   HC   _H13    98     1.09005   116.86437    -2.09919
   56    51 S   CT   _C10   109     1.50794   116.01716    64.34441
   57    56 S   HC   _H14   110     1.09439   110.25709   -82.28055
   58    56 S   HC   _H15   111     1.09282   112.85112   155.86082
   59    56 S   HC   _H16   112     1.09486   111.06813    37.47648
   60    52 S   CT   _C24    46     1.51833   116.61383   -11.37906
   61    60 S   HC   _H25    47     1.09246   106.31797   -65.96374
   62    60 S   HC   _H26    48     1.09158   107.83909    52.61087
   63    54 S   C5B  _C6_    99     1.42840   128.94407   177.48005
   64    60 S   CT   _C23    49     1.54036   113.50074   172.28019
   65    64 S   HC   _H8_    50     1.09668   109.68529    35.57791
   66    63 S   C5A  _C7_   100     1.38034   123.38701   157.55429
   67    66 S   HA   _H12   101     1.08137   129.07942    -1.80754
   68    64 S   CT   _C22    51     1.57171   115.03063   157.15812
   69    64 S   OH   _O36    94     1.43298   108.04315   -78.92746
   70    69 S   HO   _H27    95     0.97386   107.58611   -66.66991
   71    66 S   SA   _S1_   102     1.71436   109.65438   178.58128
   72    68 S   CO4  _C21    52     1.55380   111.49250    54.81232
   73    72 S   O    _O33    53     1.23595   120.22560    19.34350
   74    68 S   CT   _C26    86     1.54309   109.04977   172.50826
   75    74 S   HC   _H28    87     1.09574   111.12263    53.33324
   76    74 S   HC   _H29    88     1.09592   111.60242   -67.39960
   77    74 S   HC   _H30    89     1.09560   111.63230   173.28753
   78    68 S   CT   _C27    90     1.53669   108.46374   -69.42492
   79    78 S   HC   _H31    91     1.09619   111.10576   -48.64285
   80    78 S   HC   _H32    92     1.09468   111.70465  -167.34116
   81    78 S   HC   _H33    93     1.09357   112.06607    71.81661
   82    71 S   CRA  _C5_   103     1.71943    89.48584    -0.86818
   83    72 S   CT   _C20    54     1.54213   119.88925  -165.13531
   84    83 S   HC   _H7_    55     1.09678   106.57596   -25.67653
   85    63 S   N5B  _N4_   104     1.37973   121.02760   -25.61618
   86    82 S   CT   _C4_   105     1.48677   120.01800  -179.80517
   87    86 S   HC   _H9_   106     1.09461   110.85926   -60.18910
   88    86 S   HC   _H10   107     1.09460   110.84624    60.73443
   89    86 S   HC   _H11   108     1.09479   110.44841  -179.72305
   90    83 S   CT   _C19    56     1.55416   115.46992    95.27039
   91    90 S   HC   _H6_    57     1.09752   109.53101   151.49938
   92    83 S   CT   _C28    82     1.53412   109.21188  -138.36945
   93    92 S   HC   _H34    83     1.09291   112.50109   -67.53799
   94    92 S   HC   _H35    84     1.09523   110.62735   171.68554
   95    92 S   HC   _H36    85     1.09594   110.60016    52.45611
   96    90 S   CT   _C18    58     1.55599   117.56566    27.55927
   97    96 S   HC   _H5_    59     1.09353   107.45124   -47.73238
   98    90 S   OH   _O37    80     1.43344   107.16227   -94.99741
   99    98 S   HO   _H37    81     0.97262   107.72944   -64.27379
  100    96 S   CT   _C17    60     1.55561   111.58842  -164.60858
  101   100 S   HC   _H23    61     1.09680   109.37649    52.13154
  102   100 S   HC   _H24    62     1.09729   109.51281   -63.96240
  103    96 S   CT   _C29    76     1.53171   111.74418    71.38300
  104   103 S   HC   _H38    77     1.09516   110.97549    60.33539
  105   103 S   HC   _H39    78     1.09104   111.95270   -60.43712
  106   103 S   HC   _H40    79     1.09399   111.59750  -179.34898
  107   100 S   CT   _C16    63     1.54178   116.19000   172.40196
  108   107 S   HC   _H21    64     1.09556   109.65679    72.88176
  109   107 S   HC   _H22    65     1.09608   107.85725  -171.47000
  110   107 S   CT   _C15    66     1.53716   112.27666   -49.64311
  111   110 S   HC   _H19    67     1.09504   107.10105   -42.48867
  112   110 S   HC   _H20    68     1.08906   106.23409    73.00254
  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
  19   8   2   1   1  13   6   5  14  13   5   9   4   3   2   5
   1   9  10   8   4  11   4   4   2   1   1  10   5   4   6  15
   6   5   3  16   4   1   6  19   6   8   3   2   1   4   2   1
   1   5  13   8   4   3   2   1   1  17   7   5   2   1   1  14
   9   3   1  12   6   5   4   2   1   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    42   110    41    44    48  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    42    43    50   107   110   111   112    41    44    45    46    47    48    49    51  
   38    39    40    42   110    41    44    48  
   36    37  
   37  
    0  
   39    40    42    43    50    52   110    41    44    48    51    54    56  
   40    42    43    50    41    51  
   42    43    50    41    51  
   44    45    46    47    48    49    42   100   107   108   109   110   111   112  
   43    50    52    53    60    51    54    55    63    56    57    58    59  
   50    52    51    54    56  
   45    46    47    48    49   107   110   111   112  
   46    47    48   110  
   47    48   110  
   48   110  
   49   107   110   111   112  
  110  
   52    53    60    61    62    64    51    54    56  
   54    55    63    66    85    56    57    58    59    52  
   53    60    61    62    64    65    68    69  
   60    61    62    64  
   55    63    66    67    71    82    85    56    57    58    59  
   63    66    85    56  
   57    58    59    63  
   58    59  
   59  
    0  
   61    62    64    65    68    72    74    78    69    70  
   62    64    65    68    69  
   64    65    68    69  
   66    67    71    82    85    86  
   65    68    72    73    83    74    75    76    77    78    79    80    81    69    70  
   68    72    74    78    69    70  
   67    71    82    85    86  
   71    82    85  
   72    73    83    84    90    92    74    75    76    77    78    79    80    81    69    70  
   70    72    74    78  
    0  
   82    85    86    87    88    89  
   73    83    84    90    91    96    98    92    93    94    95    74    75    76    77    78    79    80    81  
   83    84    90    92    74    78  
   75    76    77    78    79    80    81    83  
   76    77    78  
   77    78  
   78  
   79    80    81    83  
   80    81  
   81  
    0  
   85    86    87    88    89  
   84    90    91    96    97   100   103    98    99    92    93    94    95  
   90    91    96    98    92    93    94    95  
   86    87    88    89  
   87    88    89  
   88    89  
   89  
    0  
   91    96    97   100   101   102   107   103   104   105   106    98    99    92    93    94    95  
   96    97   100   103    98    99    92  
   93    94    95    96    98  
   94    95  
   95  
    0  
   97   100   101   102   107   108   109   110   103   104   105   106    98    99  
  100   101   102   107   103   104   105   106    98  
   99   100   103  
    0  
  101   102   107   108   109   110   111   112   103   104   105   106  
  102   107   108   109   110   103  
  107   108   109   110   103  
  104   105   106   107  
  105   106  
  106  
    0  
  108   109   110   111   112  
  109   110   111   112  
  110   111   112  
  111   112  
  112  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   51   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   52   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   54   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   63   3.5500   0.0700   0.284300   2.0020   1.7750   0.001000000  -0.843144165
   64   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5500   0.0700  -0.337600   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.231700   1.3810   1.2100   0.030040813   0.268726247
   68   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   69   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   71   3.5600   0.3950   0.001000   2.0080   1.7800   0.025682759  -1.666211680
   72   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   73   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   74   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5500   0.0700   0.185900   2.0020   1.7750   0.001000000  -0.843144165
   83   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   85   3.2800   0.1700  -0.480300   1.8650   1.6500   0.001000000  -0.511443539
   86   3.5000   0.0660  -0.065000   2.4950   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   90   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  111   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   340.000  1.090
   33    38   268.000  1.529
   33    41   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    42   268.000  1.529
   42    43   340.000  1.090
   42    50   320.000  1.410
   42    51   317.000  1.510
   50    52   214.000  1.327
   52    53   570.000  1.229
   52    60   317.000  1.522
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    64   268.000  1.529
   64    65   340.000  1.090
   64    68   268.000  1.529
   64    69   320.000  1.410
   68    72   317.000  1.522
   68    74   268.000  1.529
   68    78   268.000  1.529
   72    73   570.000  1.229
   72    83   317.000  1.522
   83    84   340.000  1.090
   83    90   268.000  1.529
   83    92   268.000  1.529
   90    91   340.000  1.090
   90    96   268.000  1.529
   90    98   320.000  1.410
   96    97   340.000  1.090
   96   100   268.000  1.529
   96   103   268.000  1.529
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   107   268.000  1.529
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   110   268.000  1.529
  110   111   340.000  1.090
  110   112   340.000  1.090
  110    41   268.000  1.529
   41    44   268.000  1.529
   41    48   320.000  1.410
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   48    49   553.000  0.945
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
   98    99   553.000  0.945
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    77   340.000  1.090
   78    79   340.000  1.090
   78    80   340.000  1.090
   78    81   340.000  1.090
   69    70   553.000  0.945
   51    54   549.000  1.340
   51    56   317.000  1.510
   54    55   340.000  1.080
   54    63   320.000  1.460
   63    66   520.000  1.370
   63    85   410.000  1.394
   66    67   367.000  1.080
   66    71   265.000  1.745
   71    82   250.000  1.765
   82    85   488.000  1.335
   82    86   295.000  1.488
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    89   340.000  1.090
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   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    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    41    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    42    58.35000  112.70000
   33    41   110    58.35000  112.70000
   33    41    44    58.35000  112.70000
   33    41    48    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    42    43    37.50000  110.70000
   38    42    50    50.00000  109.50000
   38    42    51    70.00000  112.02700
   40    38    39    33.00000  107.80000
   42    38    39    37.50000  110.70000
   42    38    40    37.50000  110.70000
   42    50    52    83.00000  116.90000
   42    51    54    70.00000  124.00000
   42    51    56    65.00000  117.92700
   50    42    43    35.00000  109.50000
   50    52    53    83.00000  123.40000
   50    52    60    81.00000  111.40000
   52    60    61    35.00000  109.50000
   52    60    62    35.00000  109.50000
   52    60    64    63.00000  111.10000
   60    52    53    80.00000  120.40000
   60    64    65    37.50000  110.70000
   60    64    68    58.35000  112.70000
   60    64    69    50.00000  109.50000
   62    60    61    33.00000  107.80000
   64    60    61    37.50000  110.70000
   64    60    62    37.50000  110.70000
   64    68    72    63.00000  111.10000
   64    68    74    58.35000  112.70000
   64    68    78    58.35000  112.70000
   64    69    70    55.00000  108.50000
   68    64    65    37.50000  110.70000
   68    72    73    80.00000  120.40000
   68    72    83    70.00000  116.00000
   68    74    75    37.50000  110.70000
   68    74    76    37.50000  110.70000
   68    74    77    37.50000  110.70000
   68    78    79    37.50000  110.70000
   68    78    80    37.50000  110.70000
   68    78    81    37.50000  110.70000
   72    83    84    35.00000  109.50000
   72    83    90    63.00000  111.10000
   72    83    92    63.00000  111.10000
   83    72    73    80.00000  120.40000
   83    90    91    37.50000  110.70000
   83    90    96    58.35000  112.70000
   83    90    98    50.00000  109.50000
   83    92    93    37.50000  110.70000
   83    92    94    37.50000  110.70000
   83    92    95    37.50000  110.70000
   90    83    84    37.50000  110.70000
   90    96    97    37.50000  110.70000
   90    96   100    58.35000  112.70000
   90    96   103    58.35000  112.70000
   90    98    99    55.00000  108.50000
   96    90    91    37.50000  110.70000
   96   100   101    37.50000  110.70000
   96   100   102    37.50000  110.70000
   96   100   107    58.35000  112.70000
   96   103   104    37.50000  110.70000
   96   103   105    37.50000  110.70000
   96   103   106    37.50000  110.70000
  100    96    97    37.50000  110.70000
  100   107   108    37.50000  110.70000
  100   107   109    37.50000  110.70000
  100   107   110    58.35000  112.70000
  102   100   101    33.00000  107.80000
  107   100   101    37.50000  110.70000
  107   100   102    37.50000  110.70000
  107   110   111    37.50000  110.70000
  107   110   112    37.50000  110.70000
  107   110    41    58.35000  112.70000
  109   107   108    33.00000  107.80000
  110   107   108    37.50000  110.70000
  110   107   109    37.50000  110.70000
  110    41    44    58.35000  112.70000
  110    41    48    50.00000  109.50000
  112   110   111    33.00000  107.80000
   41    33    34    37.50000  110.70000
   41    33    38    58.35000  112.70000
   41   110   111    37.50000  110.70000
   41   110   112    37.50000  110.70000
   41    44    45    37.50000  110.70000
   41    44    46    37.50000  110.70000
   41    44    47    37.50000  110.70000
   41    48    49    55.00000  108.50000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   48    41    44    50.00000  109.50000
  103    96    97    37.50000  110.70000
  103    96   100    58.35000  112.70000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
   98    90    91    35.00000  109.50000
   98    90    96    50.00000  109.50000
   92    83    84    37.50000  110.70000
   92    83    90    58.35000  112.70000
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
   74    68    72    63.00000  111.10000
   76    74    75    33.00000  107.80000
   77    74    75    33.00000  107.80000
   77    74    76    33.00000  107.80000
   78    68    72    63.00000  111.10000
   78    68    74    58.35000  112.70000
   80    78    79    33.00000  107.80000
   81    78    79    33.00000  107.80000
   81    78    80    33.00000  107.80000
   69    64    65    35.00000  109.50000
   69    64    68    50.00000  109.50000
   51    42    43    35.00000  109.50000
   51    42    50    85.00000  110.90400
   51    54    55    35.00000  120.00000
   51    54    63    60.00000  123.20500
   51    56    57    35.00000  109.50000
   51    56    58    35.00000  109.50000
   51    56    59    35.00000  109.50000
   54    63    66    60.00000  120.93500
   54    63    85    70.00000  118.40000
   63    54    55    40.00000  117.26300
   63    66    67    35.00000  130.70000
   63    66    71    80.00000  111.29200
   63    85    82    70.00000  110.00000
   66    71    82   120.00000   89.04400
   71    66    67    40.00000  122.38200
   71    82    85    80.00000  114.57700
   71    82    86    65.00000  125.49400
   82    86    87    45.00000  109.19200
   82    86    88    45.00000  109.19200
   82    86    89    45.00000  109.19200
   85    63    66    70.00000  111.00000
   86    82    85    65.00000  125.57700
   88    86    87    33.00000  107.80000
   89    86    87    33.00000  107.80000
   89    86    88    33.00000  107.80000
   56    51    54    70.00000  124.00000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    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
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   54    63    66    67   3.62500 -1.0 2.0
   54    63    66    71   3.62500 -1.0 2.0
   54    63    85    82   3.62500 -1.0 2.0
   55    54    63    66   0.56550  1.0 3.0
   55    54    63    85   0.54250  1.0 3.0
   63    66   -71    82   3.62500 -1.0 2.0
   66    63   -85    82   2.40000 -1.0 2.0
   66    71   -82    85   3.62500 -1.0 2.0
   66    71    82    86   3.62500 -1.0 2.0
   67    66    71    82   3.62500 -1.0 2.0
   71    82   -85    63   3.62500 -1.0 2.0
   71    82    86    87   0.00000  1.0 1.0
   71    82    86    88   0.00000  1.0 1.0
   71    82    86    89   0.00000  1.0 1.0
   85    63    66    67   3.62500 -1.0 2.0
   85    63   -66    71   3.62500 -1.0 2.0
   85    82    86    87   0.00000  1.0 1.0
   85    82    86    88   0.00000  1.0 1.0
   85    82    86    89   0.00000  1.0 1.0
   86    82    85    63   3.62500 -1.0 2.0
   56    51    54    55   7.00000 -1.0 2.0
   56    51    54    63   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   50    60    52    53  10.50000 -1.0 2.0
   68    83    72    73  10.50000 -1.0 2.0
   42    56    51    54  15.00000 -1.0 2.0
   63    55    54    51  15.00000 -1.0 2.0
   66    85    63    54   4.00000 -1.0 2.0
   71    67    66    63   1.10000 -1.0 2.0
   86    85    82    71   4.00000 -1.0 2.0
END
