COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -6.689  -1.922   2.057  1.00  0.00           N  
HETATM    2  C   UNL     1      -6.603  -1.047   1.338  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.494   0.056   0.432  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.244   0.422  -0.087  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.150   1.492  -0.964  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.285   2.192  -1.325  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.521   1.834  -0.816  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.634   0.770   0.054  1.00  0.00           C  
HETATM    9  O   UNL     1      -4.130  -0.267   0.269  1.00  0.00           O  
HETATM   10  C   UNL     1      -2.892   0.164  -0.299  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.758  -0.726   0.216  1.00  0.00           C  
HETATM   12  O   UNL     1      -1.947  -2.060  -0.259  1.00  0.00           O  
HETATM   13  C   UNL     1      -0.418  -0.189  -0.292  1.00  0.00           C  
HETATM   14  N   UNL     1       0.670  -1.043   0.201  1.00  0.00           N  
HETATM   15  C   UNL     1       1.975  -0.558  -0.268  1.00  0.00           C  
HETATM   16  C   UNL     1       2.001  -0.564  -1.798  1.00  0.00           C  
HETATM   17  C   UNL     1       2.201   0.868   0.240  1.00  0.00           C  
HETATM   18  C   UNL     1       3.081  -1.471   0.265  1.00  0.00           C  
HETATM   19  C   UNL     1       4.419  -0.972  -0.216  1.00  0.00           C  
HETATM   20  C   UNL     1       5.240   0.065   0.413  1.00  0.00           C  
HETATM   21  C   UNL     1       5.092   0.865   1.547  1.00  0.00           C  
HETATM   22  C   UNL     1       6.066   1.765   1.875  1.00  0.00           C  
HETATM   23  C   UNL     1       7.204   1.890   1.089  1.00  0.00           C  
HETATM   24  C   UNL     1       7.371   1.110  -0.034  1.00  0.00           C  
HETATM   25  C   UNL     1       6.391   0.188  -0.387  1.00  0.00           C  
HETATM   26  N   UNL     1       6.265  -0.713  -1.421  1.00  0.00           N  
HETATM   27  C   UNL     1       5.088  -1.399  -1.299  1.00  0.00           C  
HETATM   28  H   UNL     1      -8.601   0.491   0.446  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.189   1.777  -1.365  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.206   3.025  -2.008  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.403   2.388  -1.104  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.946   0.092  -1.385  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.700   1.198  -0.012  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.760  -0.724   1.306  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.956  -2.138  -1.222  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.416  -0.191  -1.383  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.274   0.829   0.069  1.00  0.00           H  
HETATM   38  H   UNL     1       0.650  -1.110   1.208  1.00  0.00           H  
HETATM   39  H   UNL     1       1.213   0.086  -2.178  1.00  0.00           H  
HETATM   40  H   UNL     1       2.969  -0.204  -2.146  1.00  0.00           H  
HETATM   41  H   UNL     1       1.840  -1.580  -2.160  1.00  0.00           H  
HETATM   42  H   UNL     1       2.182   0.872   1.330  1.00  0.00           H  
HETATM   43  H   UNL     1       3.169   1.228  -0.108  1.00  0.00           H  
HETATM   44  H   UNL     1       1.413   1.518  -0.140  1.00  0.00           H  
HETATM   45  H   UNL     1       3.062  -1.466   1.355  1.00  0.00           H  
HETATM   46  H   UNL     1       2.920  -2.486  -0.097  1.00  0.00           H  
HETATM   47  H   UNL     1       4.745  -2.168  -1.976  1.00  0.00           H  
HETATM   48  H   UNL     1       4.209   0.774   2.163  1.00  0.00           H  
HETATM   49  H   UNL     1       5.951   2.384   2.753  1.00  0.00           H  
HETATM   50  H   UNL     1       7.965   2.606   1.361  1.00  0.00           H  
HETATM   51  H   UNL     1       8.259   1.216  -0.639  1.00  0.00           H  
HETATM   52  H   UNL     1       6.916  -0.844  -2.128  1.00  0.00           H  
CONECT    1    2    2    2                                            
CONECT    2    1    1    1    3                                       
CONECT    3    2    4    8    8                                       
CONECT    4    3    5    5    9                                       
CONECT    5    4    4    6   29                                       
CONECT    6    5    7    7   30                                       
CONECT    7    6    6    8   31                                       
CONECT    8    3    3    7   28                                       
CONECT    9    4   10                                                 
CONECT   10    9   11   32   33                                       
CONECT   11   10   12   13   34                                       
CONECT   12   11   35                                                 
CONECT   13   11   14   36   37                                       
CONECT   14   13   15   38                                            
CONECT   15   14   16   17   18                                       
CONECT   16   15   39   40   41                                       
CONECT   17   15   42   43   44                                       
CONECT   18   15   19   45   46                                       
CONECT   19   18   20   27   27                                       
CONECT   20   19   21   25   25                                       
CONECT   21   20   22   22   48                                       
CONECT   22   21   21   23   49                                       
CONECT   23   22   24   24   50                                       
CONECT   24   23   23   25   51                                       
CONECT   25   20   20   24   26                                       
CONECT   26   25   27   52                                            
CONECT   27   19   19   26   47                                       
CONECT   28    8                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32   10                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   27                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   26                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
