COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.529  -1.794  -0.326  1.00  0.00           C  
HETATM    2  C   UNL     1       5.329   2.791   0.414  1.00  0.00           C  
HETATM    3  C   UNL     1       6.113   1.670   0.233  1.00  0.00           C  
HETATM    4  C   UNL     1       5.774  -2.053  -0.147  1.00  0.00           C  
HETATM    5  C   UNL     1       6.563  -3.169  -0.335  1.00  0.00           C  
HETATM    6  C   UNL     1       7.938  -3.042  -0.418  1.00  0.00           C  
HETATM    7  N   UNL     1       3.159   3.807   0.694  1.00  0.00           N  
HETATM    8  C   UNL     1       7.749  -0.670  -0.145  1.00  0.00           C  
HETATM    9  C   UNL     1       6.364  -0.793  -0.054  1.00  0.00           C  
HETATM   10  N   UNL     1       1.958   1.290   0.498  1.00  0.00           N  
HETATM   11  C   UNL     1       5.520   0.411   0.140  1.00  0.00           C  
HETATM   12  C   UNL     1       4.135   0.286   0.231  1.00  0.00           C  
HETATM   13  C   UNL     1       3.950   2.669   0.511  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.822  -0.678  -0.974  1.00  0.00           C  
HETATM   15  C   UNL     1       3.351   1.412   0.413  1.00  0.00           C  
HETATM   16  C   UNL     1       1.317   0.355  -0.231  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.157   0.292  -0.218  1.00  0.00           C  
HETATM   18  O   UNL     1       1.954  -0.436  -0.900  1.00  0.00           O  
HETATM   19  C   UNL     1      -0.889   1.201   0.551  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.495  -1.072   0.370  1.00  0.00           C  
HETATM   21  O   UNL     1      -8.401   0.031  -0.197  1.00  0.00           O  
HETATM   22  C   UNL     1      -7.181   0.027  -0.180  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.259   1.142   0.563  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.096  -1.058   0.381  1.00  0.00           C  
HETATM   25  N   UNL     1      -6.891  -2.259   0.944  1.00  0.00           N  
HETATM   26  C   UNL     1      -2.922   0.173  -0.193  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.401   0.109  -0.179  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.784  -2.966   1.303  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.678  -2.265   0.974  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.192  -0.733  -0.965  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.145   1.130  -0.686  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.258   2.198  -1.244  1.00  0.00           C  
HETATM   33  N   UNL     1      -6.505   1.073  -0.687  1.00  0.00           N  
HETATM   34  H   UNL     1       9.602  -1.701  -0.392  1.00  0.00           H  
HETATM   35  H   UNL     1       5.791   3.765   0.485  1.00  0.00           H  
HETATM   36  H   UNL     1       7.186   1.767   0.162  1.00  0.00           H  
HETATM   37  H   UNL     1       4.700  -2.153  -0.082  1.00  0.00           H  
HETATM   38  H   UNL     1       6.106  -4.145  -0.415  1.00  0.00           H  
HETATM   39  H   UNL     1       8.552  -3.919  -0.556  1.00  0.00           H  
HETATM   40  H   UNL     1       2.195   3.723   0.753  1.00  0.00           H  
HETATM   41  H   UNL     1       3.575   4.681   0.762  1.00  0.00           H  
HETATM   42  H   UNL     1       8.211   0.303  -0.073  1.00  0.00           H  
HETATM   43  H   UNL     1       1.455   1.879   1.083  1.00  0.00           H  
HETATM   44  H   UNL     1       3.675  -0.688   0.159  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.257  -1.380  -1.568  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.376   1.950   1.136  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.825   1.844   1.157  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.809  -2.545   1.072  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.789  -3.936   1.776  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.657  -2.574   1.138  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.706  -1.482  -1.549  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.648   1.995  -1.100  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.426   2.033  -2.309  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.218   2.281  -0.734  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.692   3.119  -1.105  1.00  0.00           H  
CONECT    1    8    6    6   34                                       
CONECT    2   13    3    3   35                                       
CONECT    3    2    2   11   36                                       
CONECT    4    9    5    5   37                                       
CONECT    5    4    4    6   38                                       
CONECT    6    1    1    5   39                                       
CONECT    7   13   40   41                                            
CONECT    8    9    9    1   42                                       
CONECT    9   11    8    8    4                                       
CONECT   10   16   15   43                                            
CONECT   11   12   12    3    9                                       
CONECT   12   15   11   11   44                                       
CONECT   13    7   15   15    2                                       
CONECT   14   30   30   17   45                                       
CONECT   15   10   13   13   12                                       
CONECT   16   18   18   17   10                                       
CONECT   17   14   16   19   19                                       
CONECT   18   16   16                                                 
CONECT   19   17   17   23   46                                       
CONECT   20   22   24   24   25                                       
CONECT   21   22   22                                                 
CONECT   22   33   21   21   20                                       
CONECT   23   26   26   19   47                                       
CONECT   24   27   20   20   29                                       
CONECT   25   20   28   48                                            
CONECT   26   30   27   23   23                                       
CONECT   27   31   31   26   24                                       
CONECT   28   25   29   29   49                                       
CONECT   29   24   28   28   50                                       
CONECT   30   14   14   26   51                                       
CONECT   31   33   27   27   52                                       
CONECT   32   33   53   54   55                                       
CONECT   33   32   31   22                                            
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43   10                                                      
CONECT   44   12                                                      
CONECT   45   14                                                      
CONECT   46   19                                                      
CONECT   47   23                                                      
CONECT   48   25                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
CONECT   52   31                                                      
CONECT   53   32                                                      
CONECT   54   32                                                      
CONECT   55   32                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
