* LIGAND DATABASE FILE (OPLS2005)
*
001     101   104    201    323     604
    1     0 S   NP   _N1_     1    29.62405   101.23801   -20.14946
    2     1 S   H    _HN1     2     1.02948    48.06225    20.59485
    3     1 S   H    _H1_     3     1.02830    71.12700   157.13110
    4     1 S   H    _H2_     4     1.02799    90.34314   -94.08695
    5     1 S   CT   _CA1     5     1.50151   154.45491    58.30062
    6     5 S   HC   _HA1     6     1.09573   105.16318   148.90217
    7     5 S   CO3  _C1_     7     1.53746   112.26169    28.68538
    8     7 S   O2Z  _O11     8     1.26379   115.02263   -46.26802
    9     7 S   O2Z  _O12     9     1.26211   114.93286   132.56227
   10     5 S   CT   _CB1    10     1.53035   107.36801   -93.17902
   11    10 S   HC   HB11    11     1.09846   109.36317   -48.88670
   12    10 S   HC   HB12    12     1.09811   110.48440    67.68676
   13    10 S   CT   _CG1    13     1.53043   112.67869  -169.77592
   14    13 S   HC   HG11    14     1.09583   110.76522   -66.66387
   15    13 S   HC   HG12    15     1.09660   109.73289    52.62902
   16    13 S   C    _CD1    16     1.51845   111.76528   173.13213
   17    16 S   O    _OE1    17     1.22782   123.09573    13.52765
   18    16 S   N    _N2_    18     1.38603   111.99381  -166.78122
   19    18 S   H    _HN2    19     1.01606   119.07566     0.95552
   20    18 S   CT1  _CA2    20     1.46323   123.32954   178.16624
   21    20 S   HC   _HA2    21     1.09741   109.25701     6.23027
   22    20 S   C    _C2_    22     1.53578   109.08581  -109.41402
   23    22 S   O    _O2_    23     1.23085   122.17323  -149.80214
   24    20 S   CT   _CB2    32     1.53478   111.44335   128.03463
   25    24 S   HC   HB21    33     1.09352   109.19833    59.30673
   26    24 S   HC   HB22    34     1.09458   110.06446   177.90819
   27    22 S   N    _N3_    24     1.38300   113.86684    37.74624
   28    27 S   H    _HN3    25     1.01559   119.57946    -3.50777
   29    24 S   S    _SG2    35     1.82973   110.65946   -62.72398
   30    27 S   CT   _CA3    26     1.45276   123.25408   177.09889
   31    30 S   HC   HA31    27     1.09548   107.53544   -64.16525
   32    30 S   HC   HA32    28     1.09556   107.95925    52.27203
   33    29 S   CT   _C20    36     1.90590   102.56810   162.66869
   34    30 S   CO3  _C3_    29     1.52968   114.07834   174.27365
   35    34 S   O2Z  _O31    30     1.26378   116.08884     0.15066
   36    34 S   O2Z  _O32    31     1.26426   114.41117  -179.79252
   37    33 S   CM   _C4_    37     1.51340   104.79642   -61.44231
   38    37 S   HC   _H32    38     1.08975   116.72081    92.74782
   39    33 S   CT   _C12    81     1.54455   108.89560    59.14637
   40    39 S   HC   _H41    82     1.09667   111.46515   -58.06802
   41    39 S   HC   _H42    83     1.09756   109.94677  -173.29346
   42    37 S   CMA  _C5_    39     1.35072   125.12265   -87.44843
   43    42 S   OM   _O26    40     1.26371   128.66833  -178.68389
   44    42 S   CT   _C15    41     1.54098   119.35198    -1.09002
   45    44 S   HC   _H47    42     1.10173   107.69885  -124.71332
   46    44 S   CT   _C14    43     1.55173   116.79346    -3.94392
   47    46 S   HC   _H45    44     1.09734   110.09464   101.00453
   48    46 S   HC   _H46    45     1.09807   107.37200  -146.32133
   49    44 S   OS   _O29    92     1.45398   108.39287   117.50972
   50    33 S   CT   _C22    46     1.58549   111.45631  -179.96044
   51    49 S   CO4  _C6_    93     1.36354   117.87075   153.17548
   52    51 S   O    _O27    94     1.22303   126.09268     0.94585
   53    50 S   CT   _C18    47     1.57722   109.20932   -62.49746
   54    53 S   HC   _H50    48     1.09851   107.38179    59.92804
   55    50 S   CT   _C24    88     1.56385   111.94786   176.52915
   56    55 S   HC   _H55    89     1.09209   113.01932    66.53309
   57    55 S   HC   _H56    90     1.09359   112.94292   -54.03357
   58    55 S   HC   _H57    91     1.09520   111.12409  -173.00454
   59    51 S   CT   _C27    95     1.51030   108.66205  -179.18964
   60    59 S   HC   _H64    96     1.09517   108.43414   -57.91284
   61    59 S   HC   _H65    97     1.09492   108.33089    60.46914
   62    53 S   CT   _C10    49     1.55189   114.78922   175.13192
   63    62 S   HC   _H37    50     1.09386   110.65443    56.87839
   64    62 S   HC   _H38    51     1.09572   109.83117   -60.29307
   65    59 S   CT   _C25    98     1.51820   112.16972  -178.72114
   66    65 S   HC   _H58    99     1.09506   111.04968   -59.82346
   67    65 S   HC   _H59   100     1.09505   111.02438    60.09725
   68    65 S   HC   _H60   101     1.09424   110.41259  -179.84934
   69    62 S   CT   _C13    52     1.54088   113.11596   179.50742
   70    69 S   HC   _H43    53     1.09772   108.50716    68.51708
   71    69 S   HC   _H44    54     1.09631   109.22339  -175.86213
   72    69 S   CT   _C21    55     1.53559   111.80730   -52.92335
   73    72 S   CT   _C17    56     1.54340   108.03919    56.06349
   74    73 S   HC   _H49    57     1.10316   108.34050    55.93254
   75    72 S   CT   _C23    84     1.55026   109.27739   -69.30270
   76    75 S   HC   _H52    85     1.09451   112.48842  -177.48013
   77    75 S   HC   _H53    86     1.09305   112.80704    61.58018
   78    75 S   HC   _H54    87     1.09629   110.57033   -57.89294
   79    73 S   CT   _C8_    58     1.52512   103.56707   168.09052
   80    79 S   HC   _H33    59     1.09475   112.03778  -155.32031
   81    79 S   HC   _H34    60     1.09566   111.53519    83.96255
   82    53 S   CT   _C16    76     1.56397   111.60345   -56.64991
   83    82 S   HC   _H48    77     1.09456   109.47780   -65.49312
   84    79 S   CT   _C11    61     1.53806   103.93739   -34.99636
   85    84 S   HC   _H39    62     1.09594   110.74412   130.52482
   86    84 S   HC   _H40    63     1.09594   110.77805  -111.20218
   87    82 S   CT   _C9_    78     1.53634   112.26409    52.77317
   88    87 S   HC   _H35    79     1.09703   109.48210  -170.95530
   89    87 S   HC   _H36    80     1.09630   109.97491    73.15892
   90    72 S   CT   _C19    64     1.54615   115.17222   165.95725
   91    90 S   HC   _H51    65     1.09876   111.20852   -40.69484
   92    90 S   OS   _O30    66     1.43277   113.61981    84.67177
   93    92 S   CO4  _C7_    67     1.36474   117.31478   -91.50330
   94    93 S   O    _O28    68     1.22280   126.09740    -1.22125
   95    93 S   CT   _C28    69     1.51050   108.76376   178.80630
   96    95 S   HC   _H66    70     1.09521   108.43787   -57.99559
   97    95 S   HC   _H67    71     1.09507   108.45686    60.41531
   98    95 S   CT   _C26    72     1.51858   112.09906  -178.70321
   99    98 S   HC   _H61    73     1.09508   111.04746   -60.13696
  100    98 S   HC   _H62    74     1.09510   111.03712    59.78774
  101    98 S   HC   _H63    75     1.09430   110.39213   179.82983
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  12   5   4   3
  23   2   1   1  14   5  13   6   5   9   4  11   6  13   5   4
   7  14   8   4  20   9   5   2   1   1   6   5   4  12   6   5
   3   2   1   1  15   5   4  19  19   9   9   3   2   1  11   6
   5   6   3   6   4   3   2   1   1   5   2   6   8   4   6   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    50    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    46    50    53    87    39    40    41    55  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    44    46    47    48    50    53    54    62    82    87    88    89    39    40    41    55    56    57    58  
   35    36  
   36  
    0  
   38    42    43    44    45    46    50    53    87    39    40    41    55    49  
   42    43    44    50    39  
   40    41    55    42    46    50    53    73    82    83    87    88    89  
   41    50    82    87    88    89  
   50    82    87    88    89  
   43    44    45    46    47    48    50    49    51  
   44    45    46    49  
   45    46    47    48    50    53    55    49    51    52    59  
   46    47    48    50    49    51  
   47    48    50    53    54    62    82    55    56    57    58    49    51  
   48    50    53    55    49  
   50    53    55    49  
   51    52    59    60    61    65    50  
   53    54    62    63    64    69    73    82    83    87    55    56    57    58  
   52    59    60    61    65    66    67    68  
   59    60    61    65  
   54    62    63    64    69    70    71    72    73    74    79    82    83    87    88    89    55    56    57    58  
   62    63    64    69    73    82    83    87    55  
   56    57    58    62    82  
   57    58  
   58  
    0  
   60    61    65    66    67    68  
   61    65    66    67    68  
   65    66    67    68  
   63    64    69    70    71    72    73    90    82    83    87    75  
   64    69    70    71    72    82  
   69    70    71    72    82  
   66    67    68  
   67    68  
   68  
    0  
   70    71    72    73    74    79    84    90    91    92    82    75    76    77    78  
   71    72    73    90    75  
   72    73    90    75  
   73    74    79    80    81    84    85    86    90    91    92    93    82    83    87    75    76    77    78  
   74    79    80    81    84    85    86    90    91    92    82    83    87    88    89    75    76    77    78  
   79    80    81    84    90    82    83    87    75  
   76    77    78    79    82    84    90    91    92  
   77    78    90  
   78    90  
   90  
   80    81    84    85    86    90    91    92    82    83    87  
   81    84    85    86    90    82  
   84    85    86    90    82  
   83    87    88    89    84    90  
   87    88    89  
   85    86    90    91    92    93  
   86    90    91    92  
   90    91    92  
   88    89  
   89  
    0  
   91    92    93    94    95  
   92    93  
   93    94    95    96    97    98  
   94    95    96    97    98    99   100   101  
   95    96    97    98  
   96    97    98    99   100   101  
   97    98    99   100   101  
   98    99   100   101  
   99   100   101  
  100   101  
  101  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   50   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   51   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   61   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   73   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   92   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   93   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   94   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   95   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   98   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    50   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.080
   37    42   465.000  1.376
   42    43   745.000  1.250
   42    44   270.000  1.512
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    49   320.000  1.410
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    50   268.000  1.529
   50    53   268.000  1.529
   50    55   268.000  1.529
   53    54   340.000  1.090
   53    62   268.000  1.529
   53    82   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    69   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   268.000  1.529
   72    73   268.000  1.529
   72    90   268.000  1.529
   72    75   268.000  1.529
   73    74   340.000  1.090
   73    79   268.000  1.529
   73    82   268.000  1.529
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    84   268.000  1.529
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    90   268.000  1.529
   90    91   340.000  1.090
   90    92   320.000  1.410
   92    93   214.000  1.327
   93    94   570.000  1.229
   93    95   317.000  1.522
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   268.000  1.529
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
   82    83   340.000  1.090
   82    87   268.000  1.529
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    39   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    78   340.000  1.090
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   49    51   214.000  1.327
   51    52   570.000  1.229
   51    59   317.000  1.522
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    65   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    50    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    42    70.00000  124.00000
   33    50    46    58.35000  112.70000
   33    50    53    58.35000  112.70000
   33    50    55    58.35000  112.70000
   33    39    87    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   37    42    43    65.00000  137.10300
   37    42    44    65.00000  122.18000
   42    37    38    40.00000  120.50800
   42    44    45    45.00000  110.52000
   42    44    46    70.00000  112.02700
   42    44    49    85.00000  110.90400
   44    42    43    85.00000  112.85300
   44    46    47    37.50000  110.70000
   44    46    48    37.50000  110.70000
   44    46    50    58.35000  112.70000
   44    49    51    83.00000  116.90000
   46    44    45    37.50000  110.70000
   46    50    53    58.35000  112.70000
   46    50    55    58.35000  112.70000
   48    46    47    33.00000  107.80000
   50    33    37    70.00000  112.02700
   50    46    47    37.50000  110.70000
   50    46    48    37.50000  110.70000
   50    53    54    37.50000  110.70000
   50    53    62    58.35000  112.70000
   50    53    82    58.35000  112.70000
   50    55    56    37.50000  110.70000
   50    55    57    37.50000  110.70000
   50    55    58    37.50000  110.70000
   53    62    63    37.50000  110.70000
   53    62    64    37.50000  110.70000
   53    62    69    58.35000  112.70000
   53    82    73    58.35000  112.70000
   53    82    83    37.50000  110.70000
   53    82    87    58.35000  112.70000
   62    53    54    37.50000  110.70000
   62    69    70    37.50000  110.70000
   62    69    71    37.50000  110.70000
   62    69    72    58.35000  112.70000
   64    62    63    33.00000  107.80000
   69    62    63    37.50000  110.70000
   69    62    64    37.50000  110.70000
   69    72    73    58.35000  112.70000
   69    72    90    58.35000  112.70000
   69    72    75    58.35000  112.70000
   71    69    70    33.00000  107.80000
   72    69    70    37.50000  110.70000
   72    69    71    37.50000  110.70000
   72    73    74    37.50000  110.70000
   72    73    79    58.35000  112.70000
   72    73    82    58.35000  112.70000
   72    90    84    58.35000  112.70000
   72    90    91    37.50000  110.70000
   72    90    92    50.00000  109.50000
   72    75    76    37.50000  110.70000
   72    75    77    37.50000  110.70000
   72    75    78    37.50000  110.70000
   73    79    80    37.50000  110.70000
   73    79    81    37.50000  110.70000
   73    79    84    58.35000  112.70000
   73    82    83    37.50000  110.70000
   73    82    87    58.35000  112.70000
   79    73    74    37.50000  110.70000
   79    84    85    37.50000  110.70000
   79    84    86    37.50000  110.70000
   79    84    90    58.35000  112.70000
   81    79    80    33.00000  107.80000
   84    79    80    37.50000  110.70000
   84    79    81    37.50000  110.70000
   84    90    91    37.50000  110.70000
   84    90    92    50.00000  109.50000
   86    84    85    33.00000  107.80000
   90    72    73    58.35000  112.70000
   90    84    85    37.50000  110.70000
   90    84    86    37.50000  110.70000
   90    92    93    83.00000  116.90000
   92    90    91    35.00000  109.50000
   92    93    94    83.00000  123.40000
   92    93    95    81.00000  111.40000
   93    95    96    35.00000  109.50000
   93    95    97    35.00000  109.50000
   93    95    98    63.00000  111.10000
   95    93    94    80.00000  120.40000
   95    98    99    37.50000  110.70000
   95    98   100    37.50000  110.70000
   95    98   101    37.50000  110.70000
   97    95    96    33.00000  107.80000
   98    95    96    37.50000  110.70000
   98    95    97    37.50000  110.70000
  100    98    99    33.00000  107.80000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
   82    53    54    37.50000  110.70000
   82    53    62    58.35000  112.70000
   82    73    74    37.50000  110.70000
   82    73    79    58.35000  112.70000
   82    87    88    37.50000  110.70000
   82    87    89    37.50000  110.70000
   82    87    39    58.35000  112.70000
   87    82    83    37.50000  110.70000
   87    39    40    37.50000  110.70000
   87    39    41    37.50000  110.70000
   89    87    88    33.00000  107.80000
   39    33    37    70.00000  112.02700
   39    33    50    58.35000  112.70000
   39    87    88    37.50000  110.70000
   39    87    89    37.50000  110.70000
   41    39    40    33.00000  107.80000
   75    72    73    58.35000  112.70000
   75    72    90    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
   55    50    53    58.35000  112.70000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   49    44    45    35.00000  109.50000
   49    44    46    50.00000  109.50000
   49    51    52    83.00000  123.40000
   49    51    59    81.00000  111.40000
   51    59    60    35.00000  109.50000
   51    59    61    35.00000  109.50000
   51    59    65    63.00000  111.10000
   59    51    52    80.00000  120.40000
   59    65    66    37.50000  110.70000
   59    65    67    37.50000  110.70000
   59    65    68    37.50000  110.70000
   61    59    60    33.00000  107.80000
   65    59    60    37.50000  110.70000
   65    59    61    37.50000  110.70000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    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
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   49    44    46    50   0.62750  1.0 1.0
   49    44    46    50  -0.30950 -1.0 2.0
   49    44    46    50   0.27300  1.0 3.0
   49    51    59    60   0.00000  1.0 1.0
   49    51    59    61   0.00000  1.0 1.0
   49    51    59    65   0.36750  1.0 3.0
   51    59    65    66  -0.11250  1.0 3.0
   51    59    65    67  -0.11250  1.0 3.0
   51    59    65    68  -0.11250  1.0 3.0
   52    51    59    60   0.00000  1.0 1.0
   52    51    59    61   0.00000  1.0 1.0
   52    51    59    65   0.30150 -1.0 2.0
   60    59    65    66   0.15000  1.0 3.0
   60    59    65    67   0.15000  1.0 3.0
   60    59    65    68   0.15000  1.0 3.0
   61    59    65    66   0.15000  1.0 3.0
   61    59    65    67   0.15000  1.0 3.0
   61    59    65    68   0.15000  1.0 3.0
IPHI
    9     5     7     8  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    34    35  10.50000 -1.0 2.0
   33    38    37    42   1.10000 -1.0 2.0
   44    43    42    37   1.10000 -1.0 2.0
   92    95    93    94  10.50000 -1.0 2.0
   49    59    51    52  10.50000 -1.0 2.0
END
