* LIGAND DATABASE FILE (OPLS2005)
*
001     101   104    201    323     604
    1     0 S   NP   _N1_     1    28.61621    92.64757   -26.78160
    2     1 S   H    _HN1     2     1.02776   113.12338  -115.18276
    3     1 S   H    _H1_     3     1.02957   100.99547     0.37898
    4     1 S   H    _H2_     4     1.02835     6.69595  -154.65578
    5     1 S   CT   _CA1     5     1.50128   111.13930   117.48345
    6     5 S   HC   _HA1     6     1.09574   105.21947    66.34225
    7     5 S   CO3  _C1_     7     1.53790   112.36713   -53.85885
    8     7 S   O2Z  _O11     8     1.26366   114.99677   -43.82041
    9     7 S   O2Z  _O12     9     1.26236   114.93421   135.29468
   10     5 S   CT   _CB1    10     1.53098   107.42269  -175.73846
   11    10 S   HC   HB11    11     1.09827   109.34613   -50.46805
   12    10 S   HC   HB12    12     1.09816   110.42100    66.09279
   13    10 S   CT   _CG1    13     1.53013   112.66380  -171.53858
   14    13 S   HC   HG11    14     1.09595   110.48517   -64.15781
   15    13 S   HC   HG12    15     1.09656   109.92531    55.04053
   16    13 S   C    _CD1    16     1.51839   112.32799   175.41991
   17    16 S   O    _OE1    17     1.22745   123.29430     0.02798
   18    16 S   N    _N2_    18     1.38552   111.68897   179.97202
   19    18 S   H    _HN2    19     1.01557   119.02166     4.65480
   20    18 S   CT1  _CA2    20     1.45888   122.93257   178.03666
   21    20 S   HC   _HA2    21     1.09714   109.00375    23.01268
   22    20 S   C    _C2_    22     1.52880   106.64572   -94.22314
   23    22 S   O    _O2_    23     1.23010   122.88614   -30.03235
   24    20 S   CT   _CB2    32     1.53378   112.25740   146.23646
   25    24 S   HC   HB21    33     1.09481   109.41902    55.02751
   26    24 S   HC   HB22    34     1.09357   109.59786   173.86259
   27    22 S   N    _N3_    24     1.38464   112.75497   152.71335
   28    27 S   H    _HN3    25     1.01669   120.43506    -1.61422
   29    24 S   S    _SG2    35     1.82925   110.59090   -65.10528
   30    27 S   CT   _CA3    26     1.45370   122.31324   178.73452
   31    30 S   HC   HA31    27     1.09572   107.56938   -60.78804
   32    30 S   HC   HA32    28     1.09573   107.80628    55.48783
   33    29 S   CT   _C20    36     1.89972   103.14439  -172.40462
   34    30 S   CO3  _C3_    29     1.52862   114.48116   177.41775
   35    34 S   O2Z  _O31    30     1.26309   116.10108    -1.20626
   36    34 S   O2Z  _O32    31     1.26456   114.38256   178.83736
   37    33 S   CM   _C4_    37     1.52049   104.93455    67.21198
   38    37 S   HC   _H32    38     1.09088   115.89165   -81.96273
   39    33 S   CT   _C12    81     1.54717   108.03705   -51.05041
   40    39 S   HC   _H41    82     1.09656   111.14919    64.27435
   41    39 S   HC   _H42    83     1.09768   110.31861   -53.40248
   42    37 S   CMA  _C5_    39     1.35035   127.02983    97.55754
   43    42 S   OM   _O26    40     1.26395   128.53079  -178.45642
   44    42 S   CT   _C15    41     1.53416   119.70676    -0.34092
   45    44 S   HC   _H47    42     1.10105   108.55561  -125.21721
   46    44 S   CT   _C14    43     1.54325   115.11026    -5.18455
   47    46 S   HC   _H45    44     1.09592   110.19676   159.95353
   48    46 S   HC   _H46    45     1.09785   107.54795   -86.32827
   49    44 S   OS   _O29    92     1.45340   108.47735   116.91613
   50    33 S   CT   _C22    46     1.59275   111.35536  -172.96363
   51    49 S   CO4  _C6_    93     1.36406   117.87309   149.01550
   52    51 S   O    _O27    94     1.22304   126.12374     2.04775
   53    50 S   CT   _C18    47     1.59122   110.13744   170.78992
   54    53 S   HC   _H50    48     1.09763   107.36500    62.20446
   55    50 S   CT   _C24    88     1.55588   111.81526    49.27804
   56    55 S   HC   _H55    89     1.09320   112.31585    59.83098
   57    55 S   HC   _H56    90     1.09425   112.39585   -61.45648
   58    55 S   HC   _H57    91     1.09397   111.71145  -179.03187
   59    51 S   CT   _C27    95     1.51067   108.73308  -178.10143
   60    59 S   HC   _H64    96     1.09488   108.56121   -56.93989
   61    59 S   HC   _H65    97     1.09504   108.41839    61.46426
   62    53 S   CT   _C10    49     1.55611   114.60909   178.56878
   63    62 S   HC   _H37    50     1.09319   110.64557    57.90141
   64    62 S   HC   _H38    51     1.09345   110.41997   -59.18982
   65    59 S   CT   _C25    98     1.51844   112.10291  -177.61912
   66    65 S   HC   _H58    99     1.09507   111.05591   -60.17041
   67    65 S   HC   _H59   100     1.09510   111.02499    59.76235
   68    65 S   HC   _H60   101     1.09431   110.38853   179.79442
   69    62 S   CT   _C13    52     1.53919   113.56394   179.96044
   70    69 S   HC   _H43    53     1.09759   108.63226    67.84046
   71    69 S   HC   _H44    54     1.09627   109.24013  -176.39815
   72    69 S   CT   _C21    55     1.53399   111.46916   -53.69475
   73    72 S   CT   _C17    56     1.54085   107.67446    56.70239
   74    73 S   HC   _H49    57     1.10341   108.19274    55.90637
   75    72 S   CT   _C23    84     1.54990   109.57533   -68.51250
   76    75 S   HC   _H52    85     1.09460   112.46340  -176.47708
   77    75 S   HC   _H53    86     1.09304   112.82033    62.71901
   78    75 S   HC   _H54    87     1.09625   110.56350   -56.92608
   79    73 S   CT   _C8_    58     1.52573   103.52457   167.89268
   80    79 S   HC   _H33    59     1.09474   112.06841  -155.18358
   81    79 S   HC   _H34    60     1.09567   111.50606    84.06153
   82    53 S   CT   _C16    76     1.55797   112.55369   -53.07901
   83    82 S   HC   _H48    77     1.09526   109.81649   -62.89022
   84    79 S   CT   _C11    61     1.53810   103.97107   -34.92741
   85    84 S   HC   _H39    62     1.09593   110.75387   130.48058
   86    84 S   HC   _H40    63     1.09595   110.77718  -111.23782
   87    82 S   CT   _C9_    78     1.52796   110.37917    55.82389
   88    87 S   HC   _H35    79     1.09662   109.93328  -176.83331
   89    87 S   HC   _H36    80     1.09722   110.28696    66.15399
   90    72 S   CT   _C19    64     1.54578   115.10664   166.49030
   91    90 S   HC   _H51    65     1.09876   111.24729   -40.30841
   92    90 S   OS   _O30    66     1.43282   113.57829    85.06127
   93    92 S   CO4  _C7_    67     1.36476   117.31420   -91.45643
   94    93 S   O    _O28    68     1.22282   126.10201    -1.25461
   95    93 S   CT   _C28    69     1.51050   108.76353   178.77795
   96    95 S   HC   _H66    70     1.09522   108.43872   -57.88869
   97    95 S   HC   _H67    71     1.09506   108.45687    60.52330
   98    95 S   CT   _C26    72     1.51858   112.09797  -178.58861
   99    98 S   HC   _H61    73     1.09509   111.04745   -60.15797
  100    98 S   HC   _H62    74     1.09510   111.03670    59.76571
  101    98 S   HC   _H63    75     1.09430   110.39233   179.80923
  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
