COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      10.691  -1.881   0.729  1.00  0.00           C  
HETATM    2  C   UNL     1       3.732  -0.906   1.285  1.00  0.00           C  
HETATM    3  C   UNL     1       2.700   0.139   0.834  1.00  0.00           C  
HETATM    4  C   UNL     1       0.685  -1.304   1.172  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.828  -0.966  -0.371  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.699   0.260  -0.648  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.757   1.766   2.052  1.00  0.00           C  
HETATM    8  C   UNL     1      -8.626  -0.161   0.719  1.00  0.00           C  
HETATM    9  C   UNL     1       6.596   2.677  -0.361  1.00  0.00           C  
HETATM   10  C   UNL     1       6.048   1.260  -0.547  1.00  0.00           C  
HETATM   11  C   UNL     1       4.813   1.041   0.312  1.00  0.00           C  
HETATM   12  C   UNL     1       4.993  -0.513   0.566  1.00  0.00           C  
HETATM   13  C   UNL     1       7.040   0.207   0.016  1.00  0.00           C  
HETATM   14  C   UNL     1       7.528  -0.692  -1.113  1.00  0.00           C  
HETATM   15  C   UNL     1       8.558  -1.684  -0.560  1.00  0.00           C  
HETATM   16  C   UNL     1       9.687  -0.902   0.117  1.00  0.00           C  
HETATM   17  C   UNL     1       9.099  -0.018   1.220  1.00  0.00           C  
HETATM   18  C   UNL     1       1.420  -0.370   0.209  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.637  -1.748   0.542  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.508  -0.521   0.262  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.944  -0.500  -0.291  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.384   0.444   1.379  1.00  0.00           C  
HETATM   23  C   UNL     1      -8.233  -1.453  -0.003  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.128  -1.142  -1.018  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.965   1.200  -1.607  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.646   1.646  -0.974  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.773   0.420  -0.695  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.484  -0.311  -2.008  1.00  0.00           C  
HETATM   29  C   UNL     1       0.543   0.867  -0.058  1.00  0.00           C  
HETATM   30  C   UNL     1       1.247   1.871  -0.963  1.00  0.00           C  
HETATM   31  C   UNL     1       2.632   2.261  -0.416  1.00  0.00           C  
HETATM   32  C   UNL     1       3.429   0.984  -0.266  1.00  0.00           C  
HETATM   33  C   UNL     1       3.439   0.218  -1.591  1.00  0.00           C  
HETATM   34  O   UNL     1       6.314  -0.591   0.993  1.00  0.00           O  
HETATM   35  O   UNL     1       8.128   0.866   0.652  1.00  0.00           O  
HETATM   36  O   UNL     1       3.322  -2.218   0.894  1.00  0.00           O  
HETATM   37  O   UNL     1      -4.932  -0.155  -1.239  1.00  0.00           O  
HETATM   38  O   UNL     1      -6.385   0.680   0.385  1.00  0.00           O  
HETATM   39  O   UNL     1      -6.627   2.272   2.766  1.00  0.00           O  
HETATM   40  O   UNL     1      -9.605  -0.451   1.719  1.00  0.00           O  
HETATM   41  O   UNL     1      -9.371  -1.987  -0.682  1.00  0.00           O  
HETATM   42  O   UNL     1      -6.702  -2.353  -1.646  1.00  0.00           O  
HETATM   43  O   UNL     1      -3.779   2.345  -1.868  1.00  0.00           O  
HETATM   44  H   UNL     1      11.107  -2.513  -0.055  1.00  0.00           H  
HETATM   45  H   UNL     1      11.495  -1.324   1.211  1.00  0.00           H  
HETATM   46  H   UNL     1      10.187  -2.504   1.468  1.00  0.00           H  
HETATM   47  H   UNL     1       3.877  -0.858   2.364  1.00  0.00           H  
HETATM   48  H   UNL     1       2.450   0.784   1.676  1.00  0.00           H  
HETATM   49  H   UNL     1       1.303  -2.178   1.373  1.00  0.00           H  
HETATM   50  H   UNL     1       0.484  -0.778   2.105  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.350  -1.637   0.312  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.624  -1.487  -1.307  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.902   0.781   0.287  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.060   2.487   1.293  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.581   1.601   2.746  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.039   0.547   0.000  1.00  0.00           H  
HETATM   57  H   UNL     1       7.532   2.779  -0.909  1.00  0.00           H  
HETATM   58  H   UNL     1       5.872   3.398  -0.740  1.00  0.00           H  
HETATM   59  H   UNL     1       6.773   2.862   0.698  1.00  0.00           H  
HETATM   60  H   UNL     1       5.832   1.065  -1.598  1.00  0.00           H  
HETATM   61  H   UNL     1       4.854   1.622   1.233  1.00  0.00           H  
HETATM   62  H   UNL     1       4.958  -0.974  -0.421  1.00  0.00           H  
HETATM   63  H   UNL     1       6.684  -1.240  -1.533  1.00  0.00           H  
HETATM   64  H   UNL     1       7.990  -0.083  -1.890  1.00  0.00           H  
HETATM   65  H   UNL     1       8.079  -2.339   0.169  1.00  0.00           H  
HETATM   66  H   UNL     1       8.965  -2.280  -1.376  1.00  0.00           H  
HETATM   67  H   UNL     1      10.191  -0.277  -0.620  1.00  0.00           H  
HETATM   68  H   UNL     1       8.623  -0.645   1.974  1.00  0.00           H  
HETATM   69  H   UNL     1       9.895   0.566   1.682  1.00  0.00           H  
HETATM   70  H   UNL     1       1.641  -0.893  -0.722  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.436  -2.271  -0.393  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.159  -2.415   1.227  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.712   0.000   1.198  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.538  -1.204   0.435  1.00  0.00           H  
HETATM   75  H   UNL     1      -6.997  -0.248   2.127  1.00  0.00           H  
HETATM   76  H   UNL     1      -7.867  -2.180   0.723  1.00  0.00           H  
HETATM   77  H   UNL     1      -7.510  -0.454  -1.772  1.00  0.00           H  
HETATM   78  H   UNL     1      -2.762   0.678  -2.542  1.00  0.00           H  
HETATM   79  H   UNL     1      -1.123   2.316  -1.657  1.00  0.00           H  
HETATM   80  H   UNL     1      -1.850   2.167  -0.039  1.00  0.00           H  
HETATM   81  H   UNL     1      -1.423  -0.629  -2.461  1.00  0.00           H  
HETATM   82  H   UNL     1       0.039   0.360  -2.689  1.00  0.00           H  
HETATM   83  H   UNL     1       0.137  -1.184  -1.808  1.00  0.00           H  
HETATM   84  H   UNL     1       0.326   1.357   0.892  1.00  0.00           H  
HETATM   85  H   UNL     1       1.368   1.432  -1.954  1.00  0.00           H  
HETATM   86  H   UNL     1       0.633   2.767  -1.046  1.00  0.00           H  
HETATM   87  H   UNL     1       3.132   2.931  -1.116  1.00  0.00           H  
HETATM   88  H   UNL     1       2.524   2.749   0.553  1.00  0.00           H  
HETATM   89  H   UNL     1       2.427   0.177  -1.994  1.00  0.00           H  
HETATM   90  H   UNL     1       4.092   0.727  -2.300  1.00  0.00           H  
HETATM   91  H   UNL     1       3.804  -0.794  -1.422  1.00  0.00           H  
HETATM   92  H   UNL     1       3.965  -2.910   1.104  1.00  0.00           H  
HETATM   93  H   UNL     1      -6.791   3.111   3.219  1.00  0.00           H  
HETATM   94  H   UNL     1     -10.418  -0.842   1.371  1.00  0.00           H  
HETATM   95  H   UNL     1      -9.194  -2.808  -1.162  1.00  0.00           H  
HETATM   96  H   UNL     1      -5.999  -2.231  -2.299  1.00  0.00           H  
HETATM   97  H   UNL     1      -4.657   2.133  -2.213  1.00  0.00           H  
CONECT    1   16   44   45   46                                       
CONECT    2   36    3   12   47                                       
CONECT    3   18    2   32   48                                       
CONECT    4   19   18   49   50                                       
CONECT    5    6   20   51   52                                       
CONECT    6   37    5   25   53                                       
CONECT    7   39   22   54   55                                       
CONECT    8   22   40   23   56                                       
CONECT    9   10   57   58   59                                       
CONECT   10   11   13    9   60                                       
CONECT   11   32   12   10   61                                       
CONECT   12    2   11   34   62                                       
CONECT   13   34   14   10   35                                       
CONECT   14   13   15   63   64                                       
CONECT   15   14   16   65   66                                       
CONECT   16   15   17    1   67                                       
CONECT   17   35   16   68   69                                       
CONECT   18    4   29    3   70                                       
CONECT   19   20    4   71   72                                       
CONECT   20    5   19   27   73                                       
CONECT   21   38   24   37   74                                       
CONECT   22    7    8   38   75                                       
CONECT   23    8   41   24   76                                       
CONECT   24   21   23   42   77                                       
CONECT   25    6   43   26   78                                       
CONECT   26   25   27   79   80                                       
CONECT   27   28   20   26   29                                       
CONECT   28   27   81   82   83                                       
CONECT   29   27   18   30   84                                       
CONECT   30   29   31   85   86                                       
CONECT   31   30   32   87   88                                       
CONECT   32   33    3   31   11                                       
CONECT   33   32   89   90   91                                       
CONECT   34   12   13                                                 
CONECT   35   13   17                                                 
CONECT   36    2   92                                                 
CONECT   37   21    6                                                 
CONECT   38   22   21                                                 
CONECT   39    7   93                                                 
CONECT   40    8   94                                                 
CONECT   41   23   95                                                 
CONECT   42   24   96                                                 
CONECT   43   25   97                                                 
CONECT   44    1                                                      
CONECT   45    1                                                      
CONECT   46    1                                                      
CONECT   47    2                                                      
CONECT   48    3                                                      
CONECT   49    4                                                      
CONECT   50    4                                                      
CONECT   51    5                                                      
CONECT   52    5                                                      
CONECT   53    6                                                      
CONECT   54    7                                                      
CONECT   55    7                                                      
CONECT   56    8                                                      
CONECT   57    9                                                      
CONECT   58    9                                                      
CONECT   59    9                                                      
CONECT   60   10                                                      
CONECT   61   11                                                      
CONECT   62   12                                                      
CONECT   63   14                                                      
CONECT   64   14                                                      
CONECT   65   15                                                      
CONECT   66   15                                                      
CONECT   67   16                                                      
CONECT   68   17                                                      
CONECT   69   17                                                      
CONECT   70   18                                                      
CONECT   71   19                                                      
CONECT   72   19                                                      
CONECT   73   20                                                      
CONECT   74   21                                                      
CONECT   75   22                                                      
CONECT   76   23                                                      
CONECT   77   24                                                      
CONECT   78   25                                                      
CONECT   79   26                                                      
CONECT   80   26                                                      
CONECT   81   28                                                      
CONECT   82   28                                                      
CONECT   83   28                                                      
CONECT   84   29                                                      
CONECT   85   30                                                      
CONECT   86   30                                                      
CONECT   87   31                                                      
CONECT   88   31                                                      
CONECT   89   33                                                      
CONECT   90   33                                                      
CONECT   91   33                                                      
CONECT   92   36                                                      
CONECT   93   39                                                      
CONECT   94   40                                                      
CONECT   95   41                                                      
CONECT   96   42                                                      
CONECT   97   43                                                      
MASTER        0    0    0    0    0    0    0    0   97    0   97    0
END
