COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       6.190   1.649  -0.742  1.00  0.00           N  
HETATM    2  N   UNL     1      -3.876   0.231   2.546  1.00  0.00           N  
HETATM    3  N   UNL     1      -3.061  -0.756   2.415  1.00  0.00           N  
HETATM    4  N   UNL     1      -2.618  -0.809   1.207  1.00  0.00           N  
HETATM    5  N   UNL     1     -10.910   0.231   0.076  1.00  0.00           N  
HETATM    6  N   UNL     1      -6.190   1.648   0.742  1.00  0.00           N  
HETATM    7  N   UNL     1       3.877   0.234  -2.548  1.00  0.00           N  
HETATM    8  N   UNL     1       3.062  -0.753  -2.418  1.00  0.00           N  
HETATM    9  N   UNL     1       2.619  -0.807  -1.211  1.00  0.00           N  
HETATM   10  N   UNL     1      10.910   0.231  -0.075  1.00  0.00           N  
HETATM   11  C   UNL     1      -4.828   2.074   1.073  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.981   0.864   1.372  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.178   0.204   0.506  1.00  0.00           C  
HETATM   14  C   UNL     1     -14.292  -1.975  -1.133  1.00  0.00           C  
HETATM   15  C   UNL     1     -13.916  -0.771  -2.002  1.00  0.00           C  
HETATM   16  C   UNL     1     -14.068  -1.620   0.340  1.00  0.00           C  
HETATM   17  C   UNL     1     -12.309  -0.087  -0.219  1.00  0.00           C  
HETATM   18  C   UNL     1     -12.463  -0.380  -1.713  1.00  0.00           C  
HETATM   19  C   UNL     1     -14.384  -2.837   1.212  1.00  0.00           C  
HETATM   20  C   UNL     1     -10.611   1.147   1.019  1.00  0.00           C  
HETATM   21  C   UNL     1      -9.172   1.475   1.321  1.00  0.00           C  
HETATM   22  C   UNL     1      -8.529   2.126   0.096  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.128   2.565   0.437  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.231  -1.246   0.741  1.00  0.00           C  
HETATM   25  C   UNL     1       0.231  -1.246  -0.744  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.672  -1.796   0.683  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.924  -2.041  -0.821  1.00  0.00           C  
HETATM   28  C   UNL     1       1.925  -2.040   0.817  1.00  0.00           C  
HETATM   29  C   UNL     1       1.673  -1.795  -0.687  1.00  0.00           C  
HETATM   30  C   UNL     1       4.829   2.076  -1.075  1.00  0.00           C  
HETATM   31  C   UNL     1       3.982   0.866  -1.375  1.00  0.00           C  
HETATM   32  C   UNL     1       3.178   0.206  -0.509  1.00  0.00           C  
HETATM   33  C   UNL     1      14.290  -1.976   1.135  1.00  0.00           C  
HETATM   34  C   UNL     1      13.914  -0.773   2.005  1.00  0.00           C  
HETATM   35  C   UNL     1      14.067  -1.621  -0.338  1.00  0.00           C  
HETATM   36  C   UNL     1      12.309  -0.088   0.220  1.00  0.00           C  
HETATM   37  C   UNL     1      12.462  -0.381   1.715  1.00  0.00           C  
HETATM   38  C   UNL     1      14.384  -2.837  -1.210  1.00  0.00           C  
HETATM   39  C   UNL     1      10.612   1.147  -1.018  1.00  0.00           C  
HETATM   40  C   UNL     1       9.173   1.475  -1.321  1.00  0.00           C  
HETATM   41  C   UNL     1       8.529   2.127  -0.095  1.00  0.00           C  
HETATM   42  C   UNL     1       7.129   2.566  -0.437  1.00  0.00           C  
HETATM   43  O   UNL     1     -12.705  -1.236   0.534  1.00  0.00           O  
HETATM   44  O   UNL     1     -12.124   0.786  -2.466  1.00  0.00           O  
HETATM   45  O   UNL     1     -14.052  -1.118  -3.382  1.00  0.00           O  
HETATM   46  O   UNL     1     -13.474  -3.092  -1.484  1.00  0.00           O  
HETATM   47  O   UNL     1     -14.288  -2.473   2.590  1.00  0.00           O  
HETATM   48  O   UNL     1      -6.846   3.745   0.438  1.00  0.00           O  
HETATM   49  O   UNL     1      -9.301   3.262  -0.300  1.00  0.00           O  
HETATM   50  O   UNL     1      -9.112   2.377   2.428  1.00  0.00           O  
HETATM   51  O   UNL     1     -11.501   1.706   1.624  1.00  0.00           O  
HETATM   52  O   UNL     1      -0.610  -2.223  -1.390  1.00  0.00           O  
HETATM   53  O   UNL     1       0.611  -2.224   1.386  1.00  0.00           O  
HETATM   54  O   UNL     1      12.705  -1.236  -0.532  1.00  0.00           O  
HETATM   55  O   UNL     1      12.122   0.785   2.468  1.00  0.00           O  
HETATM   56  O   UNL     1      14.050  -1.120   3.385  1.00  0.00           O  
HETATM   57  O   UNL     1      13.472  -3.094   1.486  1.00  0.00           O  
HETATM   58  O   UNL     1      14.288  -2.473  -2.588  1.00  0.00           O  
HETATM   59  O   UNL     1       6.847   3.746  -0.437  1.00  0.00           O  
HETATM   60  O   UNL     1       9.301   3.262   0.302  1.00  0.00           O  
HETATM   61  O   UNL     1       9.113   2.379  -2.427  1.00  0.00           O  
HETATM   62  O   UNL     1      11.502   1.707  -1.622  1.00  0.00           O  
HETATM   63  H   UNL     1       6.415   0.705  -0.738  1.00  0.00           H  
HETATM   64  H   UNL     1     -10.199  -0.216  -0.408  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.416   0.704   0.741  1.00  0.00           H  
HETATM   66  H   UNL     1      10.198  -0.216   0.409  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.402   2.617   0.230  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.854   2.725   1.948  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.015   0.440  -0.536  1.00  0.00           H  
HETATM   70  H   UNL     1     -15.341  -2.225  -1.291  1.00  0.00           H  
HETATM   71  H   UNL     1     -14.572   0.067  -1.769  1.00  0.00           H  
HETATM   72  H   UNL     1     -14.721  -0.794   0.618  1.00  0.00           H  
HETATM   73  H   UNL     1     -12.940   0.759   0.053  1.00  0.00           H  
HETATM   74  H   UNL     1     -11.802  -1.201  -1.993  1.00  0.00           H  
HETATM   75  H   UNL     1     -15.394  -3.185   0.997  1.00  0.00           H  
HETATM   76  H   UNL     1     -13.672  -3.634   0.995  1.00  0.00           H  
HETATM   77  H   UNL     1      -8.635   0.559   1.570  1.00  0.00           H  
HETATM   78  H   UNL     1      -8.495   1.407  -0.722  1.00  0.00           H  
HETATM   79  H   UNL     1      -0.175  -0.260   1.202  1.00  0.00           H  
HETATM   80  H   UNL     1       0.175  -0.259  -1.205  1.00  0.00           H  
HETATM   81  H   UNL     1      -1.747  -2.729   1.241  1.00  0.00           H  
HETATM   82  H   UNL     1      -2.527  -2.937  -0.964  1.00  0.00           H  
HETATM   83  H   UNL     1      -2.415  -1.177  -1.269  1.00  0.00           H  
HETATM   84  H   UNL     1       2.529  -2.936   0.959  1.00  0.00           H  
HETATM   85  H   UNL     1       2.415  -1.176   1.265  1.00  0.00           H  
HETATM   86  H   UNL     1       1.748  -2.728  -1.245  1.00  0.00           H  
HETATM   87  H   UNL     1       4.402   2.619  -0.231  1.00  0.00           H  
HETATM   88  H   UNL     1       4.856   2.727  -1.949  1.00  0.00           H  
HETATM   89  H   UNL     1       3.014   0.441   0.533  1.00  0.00           H  
HETATM   90  H   UNL     1      15.339  -2.227   1.294  1.00  0.00           H  
HETATM   91  H   UNL     1      14.571   0.065   1.772  1.00  0.00           H  
HETATM   92  H   UNL     1      14.721  -0.794  -0.615  1.00  0.00           H  
HETATM   93  H   UNL     1      12.940   0.759  -0.050  1.00  0.00           H  
HETATM   94  H   UNL     1      11.801  -1.202   1.995  1.00  0.00           H  
HETATM   95  H   UNL     1      15.394  -3.185  -0.995  1.00  0.00           H  
HETATM   96  H   UNL     1      13.672  -3.634  -0.994  1.00  0.00           H  
HETATM   97  H   UNL     1       8.636   0.560  -1.570  1.00  0.00           H  
HETATM   98  H   UNL     1       8.495   1.407   0.723  1.00  0.00           H  
HETATM   99  H   UNL     1     -11.216   1.091  -2.331  1.00  0.00           H  
HETATM  100  H   UNL     1     -13.829  -0.400  -3.991  1.00  0.00           H  
HETATM  101  H   UNL     1     -13.562  -3.369  -2.407  1.00  0.00           H  
HETATM  102  H   UNL     1     -14.476  -3.198   3.202  1.00  0.00           H  
HETATM  103  H   UNL     1      -9.374   3.944   0.380  1.00  0.00           H  
HETATM  104  H   UNL     1      -9.570   3.216   2.277  1.00  0.00           H  
HETATM  105  H   UNL     1      11.214   1.090   2.333  1.00  0.00           H  
HETATM  106  H   UNL     1      13.827  -0.403   3.994  1.00  0.00           H  
HETATM  107  H   UNL     1      13.559  -3.371   2.408  1.00  0.00           H  
HETATM  108  H   UNL     1      14.476  -3.198  -3.200  1.00  0.00           H  
HETATM  109  H   UNL     1       9.375   3.945  -0.379  1.00  0.00           H  
HETATM  110  H   UNL     1       9.571   3.217  -2.275  1.00  0.00           H  
CONECT    1   30   42   63                                            
CONECT    2    3    3   12                                            
CONECT    3    2    2    4                                            
CONECT    4    3   13   26                                            
CONECT    5   17   20   64                                            
CONECT    6   11   23   65                                            
CONECT    7    8    8   31                                            
CONECT    8    7    7    9                                            
CONECT    9    8   29   32                                            
CONECT   10   36   39   66                                            
CONECT   11    6   12   67   68                                       
CONECT   12    2   11   13   13                                       
CONECT   13    4   12   12   69                                       
CONECT   14   15   16   46   70                                       
CONECT   15   14   18   45   71                                       
CONECT   16   14   19   43   72                                       
CONECT   17    5   18   43   73                                       
CONECT   18   15   17   44   74                                       
CONECT   19   16   47   75   76                                       
CONECT   20    5   21   51   51                                       
CONECT   21   20   22   50   77                                       
CONECT   22   21   23   49   78                                       
CONECT   23    6   22   48   48                                       
CONECT   24   25   26   53   79                                       
CONECT   25   24   29   52   80                                       
CONECT   26    4   24   27   81                                       
CONECT   27   26   52   82   83                                       
CONECT   28   29   53   84   85                                       
CONECT   29    9   25   28   86                                       
CONECT   30    1   31   87   88                                       
CONECT   31    7   30   32   32                                       
CONECT   32    9   31   31   89                                       
CONECT   33   34   35   57   90                                       
CONECT   34   33   37   56   91                                       
CONECT   35   33   38   54   92                                       
CONECT   36   10   37   54   93                                       
CONECT   37   34   36   55   94                                       
CONECT   38   35   58   95   96                                       
CONECT   39   10   40   62   62                                       
CONECT   40   39   41   61   97                                       
CONECT   41   40   42   60   98                                       
CONECT   42    1   41   59   59                                       
CONECT   43   16   17                                                 
CONECT   44   18   99                                                 
CONECT   45   15  100                                                 
CONECT   46   14  101                                                 
CONECT   47   19  102                                                 
CONECT   48   23   23                                                 
CONECT   49   22  103                                                 
CONECT   50   21  104                                                 
CONECT   51   20   20                                                 
CONECT   52   25   27                                                 
CONECT   53   24   28                                                 
CONECT   54   35   36                                                 
CONECT   55   37  105                                                 
CONECT   56   34  106                                                 
CONECT   57   33  107                                                 
CONECT   58   38  108                                                 
CONECT   59   42   42                                                 
CONECT   60   41  109                                                 
CONECT   61   40  110                                                 
CONECT   62   39   39                                                 
CONECT   63    1                                                      
CONECT   64    5                                                      
CONECT   65    6                                                      
CONECT   66   10                                                      
CONECT   67   11                                                      
CONECT   68   11                                                      
CONECT   69   13                                                      
CONECT   70   14                                                      
CONECT   71   15                                                      
CONECT   72   16                                                      
CONECT   73   17                                                      
CONECT   74   18                                                      
CONECT   75   19                                                      
CONECT   76   19                                                      
CONECT   77   21                                                      
CONECT   78   22                                                      
CONECT   79   24                                                      
CONECT   80   25                                                      
CONECT   81   26                                                      
CONECT   82   27                                                      
CONECT   83   27                                                      
CONECT   84   28                                                      
CONECT   85   28                                                      
CONECT   86   29                                                      
CONECT   87   30                                                      
CONECT   88   30                                                      
CONECT   89   32                                                      
CONECT   90   33                                                      
CONECT   91   34                                                      
CONECT   92   35                                                      
CONECT   93   36                                                      
CONECT   94   37                                                      
CONECT   95   38                                                      
CONECT   96   38                                                      
CONECT   97   40                                                      
CONECT   98   41                                                      
CONECT   99   44                                                      
CONECT  100   45                                                      
CONECT  101   46                                                      
CONECT  102   47                                                      
CONECT  103   49                                                      
CONECT  104   50                                                      
CONECT  105   55                                                      
CONECT  106   56                                                      
CONECT  107   57                                                      
CONECT  108   58                                                      
CONECT  109   60                                                      
CONECT  110   61                                                      
MASTER        0    0    0    0    0    0    0    0  110    0  110    0
END
