* LIGAND DATABASE FILE (OPLS2005)
*
001     110   113    205    322     606
    1     0 S   NP   _N1_     1    30.28538    98.18161   -26.76949
    2     1 S   H    _HN1     2     1.02777   127.89578  -107.60354
    3     1 S   H    _H1_     3     1.02960    69.25847   -10.05592
    4     1 S   H    _H2_     4     1.02840    38.67227  -177.11120
    5     1 S   CT   _CA1     5     1.50142   117.02971    92.95671
    6     5 S   HC   _HA1     6     1.09577   105.20144   101.12360
    7     5 S   CO3  _C1_     7     1.53768   112.31424   -19.01459
    8     7 S   O2Z  _O11     8     1.26362   114.98429   -44.67429
    9     7 S   O2Z  _O12     9     1.26229   114.91991   134.29373
   10     5 S   CT   _CB1    10     1.53090   107.42000  -141.02304
   11    10 S   HC   HB11    11     1.09828   109.27187   -50.78781
   12    10 S   HC   HB12    12     1.09814   110.45670    65.74435
   13    10 S   CT   _CG1    13     1.53026   112.70021  -171.86964
   14    13 S   HC   HG11    14     1.09601   110.50616   -65.14739
   15    13 S   HC   HG12    15     1.09658   109.92332    54.05300
   16    13 S   C    _CD1    16     1.51844   112.27388   174.36678
   17    16 S   O    _OE1    17     1.22770   123.32219     0.77430
   18    16 S   N    _N2_    18     1.38524   111.73196  -179.08123
   19    18 S   H    _HN2    19     1.01560   119.11775     2.97730
   20    18 S   CT1  _CA2    20     1.45805   122.89037   178.39807
   21    20 S   HC   _HA2    21     1.09628   109.87708    24.73375
   22    20 S   C    _C2_    22     1.53082   104.89640   -93.39369
   23    22 S   O    _O2_    23     1.23041   122.29567   -78.20869
   24    20 S   CT   _CB2    32     1.53142   111.74311   148.06415
   25    24 S   HC   HB21    33     1.09215   109.80532    52.88927
   26    24 S   HC   HB22    34     1.09381   108.28404   171.26981
   27    22 S   N    _N3_    24     1.38537   113.08770    97.43158
   28    27 S   H    _HN3    25     1.01527   119.53038     4.45769
   29    24 S   S    _SG2    35     1.83187   111.96392   -68.49670
   30    27 S   CT   _CA3    26     1.45606   123.20225  -177.94796
   31    30 S   HC   HA31    27     1.09530   109.20561    21.64338
   32    30 S   HC   HA32    28     1.09503   106.82430   138.52951
   33    29 S   CT   _C23    36     1.89372   101.79910   167.22190
   34    33 S   OM   _O38    37     1.32064   107.43523   179.05934
   35    30 S   CO3  _C3_    29     1.52964   114.54595  -101.63298
   36    35 S   O2Z  _O31    30     1.26283   116.27168   -22.23814
   37    35 S   O2Z  _O32    31     1.26577   114.53448   158.78407
   38    33 S   CM   _C24    38     1.53701   107.64674   -66.82122
   39    38 S   CMA  _C25    39     1.36058   126.53677   124.40713
   40    39 S   OM   _O36    40     1.27086   129.69725   175.09500
   41    38 S   C    _C26   106     1.51823   118.10197   -56.02879
   42    41 S   O    _O37   107     1.22684   123.19588   -66.08078
   43    39 S   CT   _C17    41     1.55875   118.78300    -4.43085
   44    41 S   N    _N6_   108     1.37755   113.34328   113.08412
   45    44 S   H    _H22   109     1.01374   121.54576     4.85220
   46    44 S   H    _H23   110     1.01275   120.48521  -179.91844
   47    43 S   CM   _C16    42     1.53790   112.91206   -94.90937
   48    43 S   CT   _C18    89     1.56049   112.08012    30.92143
   49    48 S   HC   _H3_    90     1.09926   107.34963    65.55882
   50    43 S   OH   _O39   104     1.44993   109.81385   147.65087
   51    50 S   HO   _H30   105     0.97436   105.98980    24.53249
   52    47 S   CM   _C15    43     1.34978   122.15455   152.10789
   53    33 S   CT   _C22    91     1.59397   110.61430    59.56814
   54    53 S   HC   _H5_    92     1.09046   105.20753   -34.91439
   55    47 S   OH   _O40   102     1.38694   115.02871   -26.64171
   56    55 S   HO   _H31   103     0.97219   109.32488  -177.92755
   57    52 S   CO4  _C14    44     1.48951   120.14821  -176.99606
   58    57 S   O    _O35    45     1.22644   121.38012   -30.79305
   59    53 S   NT   _N7_    93     1.49608   120.83239    80.56495
   60    57 S   CA   _C12    46     1.48867   117.68339   148.62488
   61    59 S   CT   _C27    94     1.45849   117.58892    72.68169
   62    61 S   HC   _H24    95     1.09680   109.41581   163.27868
   63    61 S   HC   _H25    96     1.09303   112.72359    46.21685
   64    61 S   HC   _H26    97     1.09360   113.44184   -77.56127
   65    59 S   CT   _C28    98     1.45795   114.77575   -60.61348
   66    65 S   HC   _H27    99     1.09631   110.11041  -165.36624
   67    65 S   HC   _H28   100     1.09425   112.76493    74.55935
   68    65 S   HC   _H29   101     1.09502   111.31015   -48.22768
   69    60 S   CA   _C11    47     1.40800   120.35511     7.61278
   70    69 S   CA   _C10    48     1.41939   119.65198  -178.73638
   71    69 S   CT   _C21    81     1.51375   121.09151    -2.46275
   72    71 S   HC   _H20    82     1.09749   109.61422   142.53026
   73    71 S   HC   _H21    83     1.09131   106.53302  -101.68531
   74    70 S   CA   _C9_    49     1.40871   119.38361     0.59215
   75    74 S   HA   _H16    50     1.08444   117.83773   177.64549
   76    70 S   NE   _N8_    72     1.40544   120.31153   178.21710
   77    52 S   CT   _C20    84     1.50056   124.19642     4.30812
   78    77 S   HC   _H4_    85     1.10076   106.62880   113.43071
   79    74 S   CA   _C8_    51     1.39338   121.28004     0.77506
   80    76 S   CT   _C29    73     1.45801   114.59466   -91.60040
   81    80 S   HC   _H32    74     1.09528   110.18000   168.14738
   82    80 S   HC   _H33    75     1.09505   111.72917    49.03616
   83    80 S   HC   _H34    76     1.09582   110.95445   -72.16947
   84    76 S   CT   _C30    77     1.45655   116.79051   125.95476
   85    84 S   HC   _H35    78     1.09540   109.97787  -165.35277
   86    84 S   HC   _H36    79     1.09527   111.65182    74.97316
   87    84 S   HC   _H37    80     1.09582   111.06935   -46.83958
   88    77 S   CT   _C19    86     1.54554   113.95371    -3.84766
   89    88 S   HC   _H18    87     1.09916   107.58512    92.83981
   90    88 S   HC   _H19    88     1.09580   110.57632  -154.09991
   91    60 S   CA   _C13    52     1.40692   120.12268  -170.16465
   92    79 S   N    _N5_    55     1.41548   123.77238   175.23317
   93    92 S   H    _H15    56     1.01951   113.87258  -173.40498
   94    91 S   OH   _O34    53     1.37562   122.53052    -0.90287
   95    94 S   HO   _H17    54     0.97328   109.29162     1.79253
   96    92 S   C    _C7_    57     1.38560   128.13822     2.58642
   97    96 S   O    _O33    58     1.22813   127.58924     5.95789
   98    96 S   CT1  _C6_    59     1.51786   111.58020  -173.32626
   99    98 S   HC   _H13    60     1.09520   107.75731    92.64931
  100    98 S   HC   _H14    61     1.09466   112.58538   -28.61161
  101    98 S   NP   _N4_    62     1.51792   111.71002  -149.63131
  102   101 S   H    _H9_    63     1.02998   106.53112   -46.16069
  103   101 S   CT   _C4_    64     1.50418   112.66534    70.97489
  104   103 S   HC   _H6_    65     1.09329   108.60024    62.88508
  105   103 S   HC   _H7_    66     1.09325   107.99177  -176.75750
  106   103 S   HC   _H8_    67     1.09250   108.59138   -57.89363
  107   101 S   CT   _C5_    68     1.50266   111.65369  -162.57971
  108   107 S   HC   _H10    69     1.09326   108.59571   -62.45934
  109   107 S   HC   _H11    70     1.09315   108.12548    58.14830
  110   107 S   HC   _H12    71     1.09318   108.11588   176.94392
  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   9   5   4   3
  16   7   2   1   1  14  14   5   6   3  16   2   1   1  15  16
   8   5   1  15  14   4   3   1  11   4   9  13   7   3   2   1
   3   2   1   1  15  18  10   4   3  10   4   9   4   3   8   7
   3   2   1   3   2   1   1   2   1   1   5   8   3   1   1   8
   4  12   5   4   9   8   7   3   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    53    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    48    53    54    59    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    88    48    49    53    54    59    61    65    41    42    44  
   38    39    48    53    54    59    41  
   36    37  
   37  
    0  
   39    40    43    47    48    53    54    59    50    41    42    44    45    46  
   40    43    47    52    88    48    49    53    55    50    51    41    42    44  
   43    47    48    50    41  
   42    44    45    46    43    53  
   44    45    46  
   47    52    57    77    88    89    90    48    49    53    54    59    55    56    50    51  
   45    46  
   46  
    0  
   52    57    58    60    71    77    78    88    48    49    53    55    56    50    51  
   49    53    54    59    61    65    55    50    51    52    71    77    78    88    89    90  
   53    54    59    50    77    88    89    90  
   51    52    53    55    88  
    0  
   57    58    60    69    91    71    72    73    77    78    88    89    90    55    56  
   54    59    61    62    63    64    65    66    67    68    77    88    89    90  
   59    61    65    88  
   56    57    77  
    0  
   58    60    69    70    79    91    94    71    77    78    88  
   60    69    91    77  
   61    62    63    64    65    66    67    68    88  
   69    70    74    79    91    94    95    92    76    71    72    73    77  
   62    63    64    65    66    67    68  
   63    64    65  
   64    65  
   65  
   66    67    68  
   67    68  
   68  
    0  
   70    74    75    79    91    94    76    80    84    71    72    73    77    78    88  
   74    75    79    91    92    76    80    81    82    83    84    85    86    87    71    72    73    77  
   72    73    77    78    88    89    90    74    76    91  
   73    77    78    88  
   77    78    88  
   75    79    91    94    92    93    96    76    80    84  
   79    91    92    76  
   80    81    82    83    84    85    86    87    79  
   78    88    89    90  
   88    89    90  
   91    94    95    92    93    96    97    98  
   81    82    83    84    85    86    87  
   82    83    84  
   83    84  
   84  
   85    86    87  
   86    87  
   87  
    0  
   89    90  
   90  
    0  
   94    95    92    93    96  
   93    96    97    98    99   100   101    94  
   96    97    98  
   95  
    0  
   97    98    99   100   101   102   103   107  
   98    99   100   101  
   99   100   101   102   103   104   105   106   107   108   109   110  
  100   101   102   103   107  
  101   102   103   107  
  102   103   104   105   106   107   108   109   110  
  103   104   105   106   107   108   109   110  
  104   105   106   107   108   109   110  
  105   106   107  
  106   107  
  107  
  108   109   110  
  109   110  
  110  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   4.2000   0.3000  -0.012500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.657900   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   40   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   41   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.500000   1.8100   1.6000   0.001000000  -1.480495490
   43   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   44   3.2500   0.1700  -0.760000   1.8100   1.6000   0.054801302  -1.445846770
   45   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   46   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   47   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   53   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   57   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   58   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   59   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   60   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   61   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   70   3.5500   0.0700   0.210000   2.5000   1.7750   0.001000000  -0.843144165
   71   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   75   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   76   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   77   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   80   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   92   3.2500   0.1700  -0.385000   1.8100   1.6000   0.054801302  -1.445846770
   93   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   94   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   95   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   96   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   97   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   98   3.5000   0.0660   0.002500   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  100   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  101   3.2500   0.1700   0.047500   2.1950   1.9500   0.003973653   1.685851020
  102   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
  103   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  106   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  107   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.6450   1.4500   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   570.000  1.307
   33    38   317.000  1.510
   33    53   268.000  1.529
   38    39   465.000  1.376
   38    41   410.000  1.444
   39    40   745.000  1.250
   39    43   270.000  1.512
   43    47   317.000  1.510
   43    48   268.000  1.529
   43    50   320.000  1.410
   47    52   549.000  1.340
   47    55   510.000  1.338
   52    57   320.000  1.462
   52    77   317.000  1.510
   57    58   570.000  1.229
   57    60   310.000  1.470
   60    69   469.000  1.400
   60    91   469.000  1.400
   69    70   469.000  1.400
   69    71   317.000  1.510
   70    74   469.000  1.400
   70    76   481.000  1.340
   74    75   367.000  1.080
   74    79   469.000  1.400
   79    91   469.000  1.400
   79    92   360.000  1.404
   91    94   450.000  1.364
   94    95   553.000  0.945
   92    93   434.000  1.010
   92    96   490.000  1.335
   96    97   570.000  1.229
   96    98   317.000  1.522
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   367.000  1.471
  101   102   434.000  1.010
  101   103   367.000  1.471
  101   107   367.000  1.471
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   110   340.000  1.090
   76    80   382.000  1.448
   76    84   382.000  1.448
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    83   340.000  1.090
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    87   340.000  1.090
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    77   268.000  1.529
   77    78   340.000  1.090
   77    88   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    48   268.000  1.529
   48    49   340.000  1.090
   48    53   268.000  1.529
   53    54   340.000  1.090
   53    59   382.000  1.448
   59    61   382.000  1.448
   59    65   382.000  1.448
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   55    56   553.000  0.945
   50    51   553.000  0.945
   41    42   570.000  1.229
   41    44   490.000  1.335
   44    45   434.000  1.010
   44    46   434.000  1.010
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    85.00000  114.68000
   29    33    38    75.00000  112.20000
   29    33    53    75.00000  111.63000
   33    38    39    70.00000  124.00000
   33    38    41    70.00000  119.70000
   33    53    48    58.35000  112.70000
   33    53    54    37.50000  110.70000
   33    53    59    56.20000  109.47000
   38    33    34    85.00000  110.90400
   38    39    40    65.00000  137.10300
   38    39    43    65.00000  122.18000
   38    41    42    80.00000  125.30000
   38    41    44    80.00000  111.56200
   39    43    47    70.00000  110.12100
   39    43    48    70.00000  112.02700
   39    43    50    90.00000  110.39200
   43    39    40    85.00000  112.85300
   43    47    52    70.00000  124.00000
   43    47    55    90.00000  109.34000
   43    48    88    58.35000  112.70000
   43    48    49    37.50000  110.70000
   43    48    53    58.35000  112.70000
   43    50    51    55.00000  108.50000
   47    52    57    65.00000  118.96000
   47    52    77    70.00000  124.00000
   47    55    56    70.00000  107.45700
   52    57    58    80.00000  123.72100
   52    57    60    65.00000  117.02400
   52    77    71    70.00000  112.02700
   52    77    78    35.00000  109.50000
   52    77    88    70.00000  112.02700
   57    60    69    60.00000  119.52600
   57    60    91    60.00000  119.52600
   60    57    58    75.00000  123.78400
   60    69    70    63.00000  120.00000
   60    69    71    70.00000  120.00000
   60    91    79    63.00000  120.00000
   60    91    94    70.00000  120.00000
   69    70    74    63.00000  120.00000
   69    70    76    70.00000  120.10000
   69    71    72    35.00000  109.50000
   69    71    73    35.00000  109.50000
   69    71    77    70.00000  112.17500
   70    74    75    35.00000  120.00000
   70    74    79    63.00000  120.00000
   70    76    80    50.00000  120.00000
   70    76    84    50.00000  120.00000
   74    79    91    63.00000  120.00000
   74    79    92    70.00000  119.01900
   79    74    75    35.00000  120.00000
   79    91    94    70.00000  120.00000
   79    92    93    45.00000  118.23600
   79    92    96    65.00000  121.96500
   91    60    69    63.00000  120.00000
   91    94    95    35.00000  113.00000
   92    79    91    70.00000  119.01900
   92    96    97    80.00000  122.90000
   92    96    98    70.00000  116.60000
   96    92    93    35.00000  119.80000
   96    98    99    35.00000  109.50000
   96    98   100    35.00000  109.50000
   96    98   101    80.00000  111.20000
   98    96    97    80.00000  120.40000
   98   101   102    35.00000  109.50000
   98   101   103    75.00000  113.01200
   98   101   107    75.00000  113.01200
  100    98    99    33.00000  107.80000
  101    98    99    35.00000  109.50000
  101    98   100    35.00000  109.50000
  101   103   104    35.00000  109.50000
  101   103   105    35.00000  109.50000
  101   103   106    35.00000  109.50000
  101   107   108    35.00000  109.50000
  101   107   109    35.00000  109.50000
  101   107   110    35.00000  109.50000
  103   101   102    35.00000  109.50000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
  107   101   102    35.00000  109.50000
  107   101   103    75.00000  113.01200
  109   107   108    33.00000  107.80000
  110   107   108    33.00000  107.80000
  110   107   109    33.00000  107.80000
   76    70    74    70.00000  120.10000
   76    80    81    35.00000  109.50000
   76    80    82    35.00000  109.50000
   76    80    83    35.00000  109.50000
   76    84    85    35.00000  109.50000
   76    84    86    35.00000  109.50000
   76    84    87    35.00000  109.50000
   82    80    81    33.00000  107.80000
   83    80    81    33.00000  107.80000
   83    80    82    33.00000  107.80000
   84    76    80    50.00000  115.00000
   86    84    85    33.00000  107.80000
   87    84    85    33.00000  107.80000
   87    84    86    33.00000  107.80000
   71    69    70    70.00000  120.00000
   71    77    78    37.50000  110.70000
   71    77    88    58.35000  112.70000
   73    71    72    33.00000  107.80000
   77    52    57    65.00000  116.34900
   77    71    72    37.50000  110.70000
   77    71    73    37.50000  110.70000
   77    88    89    37.50000  110.70000
   77    88    90    37.50000  110.70000
   77    88    48    58.35000  112.70000
   88    77    78    37.50000  110.70000
   88    48    49    37.50000  110.70000
   88    48    53    58.35000  112.70000
   90    88    89    33.00000  107.80000
   48    43    47    70.00000  112.02700
   48    88    89    37.50000  110.70000
   48    88    90    37.50000  110.70000
   48    53    54    37.50000  110.70000
   48    53    59    56.20000  109.47000
   53    33    34    50.00000  109.50000
   53    33    38    70.00000  112.02700
   53    48    49    37.50000  110.70000
   53    59    61    51.80000  107.20000
   53    59    65    51.80000  107.20000
   59    53    54    35.00000  109.50000
   59    61    62    35.00000  109.50000
   59    61    63    35.00000  109.50000
   59    61    64    35.00000  109.50000
   59    65    66    35.00000  109.50000
   59    65    67    35.00000  109.50000
   59    65    68    35.00000  109.50000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   65    59    61    51.80000  107.20000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   55    47    52    80.00000  121.38400
   50    43    47    90.00000  110.39200
   50    43    48    50.00000  109.50000
   41    38    39    60.00000  120.04000
   41    44    45    35.00000  119.80000
   41    44    46    35.00000  119.80000
   44    41    42    80.00000  122.90000
   46    44    45    35.00000  120.00000
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
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   61    59    65    67   0.28000  1.0 3.0
   61    59    65    68   0.28000  1.0 3.0
   65    59    61    62   0.28000  1.0 3.0
   65    59    61    63   0.28000  1.0 3.0
   65    59    61    64   0.28000  1.0 3.0
   55    47    52    57   7.00000 -1.0 2.0
   55    47    52    77   7.00000 -1.0 2.0
   50    43    47    52   0.67800  1.0 1.0
   50    43    47    52   0.47050 -1.0 2.0
   50    43    47    52  -0.62500  1.0 3.0
   50    43    47    55   0.09700  1.0 1.0
   50    43    47    55   0.15600 -1.0 2.0
   50    43    47    55  -0.50800  1.0 3.0
   50    43    48    88   0.86500  1.0 1.0
   50    43    48    88  -0.17500 -1.0 2.0
   50    43    48    88   0.20800  1.0 3.0
   50    43    48    49   0.23400  1.0 3.0
   50    43    48    53   0.86500  1.0 1.0
   50    43    48    53  -0.17500 -1.0 2.0
   50    43    48    53   0.20800  1.0 3.0
   41    38    39    40   7.00000 -1.0 2.0
   41    38    39    43   7.00000 -1.0 2.0
   42    41    44    45   2.45000 -1.0 2.0
   42    41    44    46   2.45000 -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
   33    41    38    39   1.10000 -1.0 2.0
   43    40    39    38   1.10000 -1.0 2.0
   43    55    47    52   1.10000 -1.0 2.0
   57    77    52    47   1.10000 -1.0 2.0
   52    60    57    58  10.50000 -1.0 2.0
   69    91    60    57   4.00000 -1.0 2.0
   70    71    69    60   4.00000 -1.0 2.0
   74    76    70    69   4.00000 -1.0 2.0
   79    75    74    70   1.10000 -1.0 2.0
   91    92    79    74   4.00000 -1.0 2.0
   79    94    91    60   4.00000 -1.0 2.0
   93    96    92    79   1.00000 -1.0 2.0
   92    98    96    97  10.50000 -1.0 2.0
   84    70    76    80   1.00000 -1.0 2.0
   38    44    41    42  10.50000 -1.0 2.0
   46    41    44    45   1.00000 -1.0 2.0
END
