COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.455   0.749   0.079  1.00  0.00           C  
HETATM    2  C   UNL     1       0.067   0.828  -0.682  1.00  0.00           C  
HETATM    3  C   UNL     1       0.489  -0.339  -0.035  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.052   0.181  -0.045  1.00  0.00           C  
HETATM    5  N   UNL     1      -6.082   2.046  -0.042  1.00  0.00           N  
HETATM    6  C   UNL     1      -4.770   2.379  -0.155  1.00  0.00           C  
HETATM    7  C   UNL     1       2.706  -0.819  -1.042  1.00  0.00           C  
HETATM    8  C   UNL     1       1.917  -0.718   0.266  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.609  -1.066   0.273  1.00  0.00           C  
HETATM   10  C   UNL     1       2.553   0.353   1.156  1.00  0.00           C  
HETATM   11  O   UNL     1      -7.626   0.433   0.180  1.00  0.00           O  
HETATM   12  C   UNL     1      -5.387  -0.261   0.077  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.637  -1.628   0.191  1.00  0.00           C  
HETATM   14  N   UNL     1      -3.806   1.507  -0.155  1.00  0.00           N  
HETATM   15  C   UNL     1      -3.027  -0.779  -0.047  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.324  -2.060   0.065  1.00  0.00           N  
HETATM   17  C   UNL     1      -4.566  -2.497   0.180  1.00  0.00           C  
HETATM   18  N   UNL     1      -1.694  -0.378  -0.167  1.00  0.00           N  
HETATM   19  N   UNL     1      -1.239   0.806  -0.762  1.00  0.00           N  
HETATM   20  C   UNL     1       4.020  -0.007   1.408  1.00  0.00           C  
HETATM   21  N   UNL     1       4.732  -0.090   0.127  1.00  0.00           N  
HETATM   22  C   UNL     1       4.168  -1.144  -0.727  1.00  0.00           C  
HETATM   23  H   UNL     1       0.709   1.615  -1.050  1.00  0.00           H  
HETATM   24  H   UNL     1      -6.758   2.742  -0.049  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.514   3.424  -0.250  1.00  0.00           H  
HETATM   26  H   UNL     1       2.283  -1.610  -1.662  1.00  0.00           H  
HETATM   27  H   UNL     1       2.651   0.130  -1.575  1.00  0.00           H  
HETATM   28  H   UNL     1       1.938  -1.679   0.780  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.621  -2.021   0.778  1.00  0.00           H  
HETATM   30  H   UNL     1       2.497   1.321   0.658  1.00  0.00           H  
HETATM   31  H   UNL     1       2.021   0.400   2.106  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.647  -1.999   0.285  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.746  -3.559   0.268  1.00  0.00           H  
HETATM   34  H   UNL     1       4.480   0.761   2.030  1.00  0.00           H  
HETATM   35  H   UNL     1       4.075  -0.968   1.919  1.00  0.00           H  
HETATM   36  H   UNL     1       4.223  -2.101  -0.207  1.00  0.00           H  
HETATM   37  H   UNL     1       4.736  -1.202  -1.655  1.00  0.00           H  
HETATM   38  C   UNL     1       6.171  -0.297   0.337  1.00  0.00           C  
HETATM   39  C   UNL     1       6.895  -0.382  -1.018  1.00  0.00           C  
HETATM   40  C   UNL     1       7.913   0.777  -1.047  1.00  0.00           C  
HETATM   41  C   UNL     1       8.175   1.090   0.447  1.00  0.00           C  
HETATM   42  C   UNL     1       6.774   0.910   1.084  1.00  0.00           C  
HETATM   43  H   UNL     1       6.337  -1.211   0.907  1.00  0.00           H  
HETATM   44  H   UNL     1       7.413  -1.337  -1.106  1.00  0.00           H  
HETATM   45  H   UNL     1       6.178  -0.269  -1.832  1.00  0.00           H  
HETATM   46  H   UNL     1       8.834   0.463  -1.538  1.00  0.00           H  
HETATM   47  H   UNL     1       7.488   1.645  -1.550  1.00  0.00           H  
HETATM   48  H   UNL     1       8.886   0.381   0.871  1.00  0.00           H  
HETATM   49  H   UNL     1       8.527   2.114   0.571  1.00  0.00           H  
HETATM   50  H   UNL     1       6.166   1.800   0.926  1.00  0.00           H  
HETATM   51  H   UNL     1       6.865   0.693   2.149  1.00  0.00           H  
CONECT    1   12    5   11   11                                       
CONECT    2   19   19    3   23                                       
CONECT    3    2    8    9    9                                       
CONECT    4   15   14   12   12                                       
CONECT    5    6    1   24                                            
CONECT    6   14   14    5   25                                       
CONECT    7    8   22   26   27                                       
CONECT    8   10    3    7   28                                       
CONECT    9    3    3   18   29                                       
CONECT   10   20    8   30   31                                       
CONECT   11    1    1                                                 
CONECT   12    4    4   13    1                                       
CONECT   13   17   17   12   32                                       
CONECT   14    4    6    6                                            
CONECT   15   18   16   16    4                                       
CONECT   16   15   15   17                                            
CONECT   17   16   13   13   33                                       
CONECT   18   19    9   15                                            
CONECT   19    2    2   18                                            
CONECT   20   10   21   34   35                                       
CONECT   21   20   22   38                                            
CONECT   22   21    7   36   37                                       
CONECT   23    2                                                      
CONECT   24    5                                                      
CONECT   25    6                                                      
CONECT   26    7                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   10                                                      
CONECT   32   13                                                      
CONECT   33   17                                                      
CONECT   34   20                                                      
CONECT   35   20                                                      
CONECT   36   22                                                      
CONECT   37   22                                                      
CONECT   38   21   39   42   43                                       
CONECT   39   38   40   44   45                                       
CONECT   40   39   41   46   47                                       
CONECT   41   40   42   48   49                                       
CONECT   42   41   38   50   51                                       
CONECT   43   38                                                      
CONECT   44   39                                                      
CONECT   45   39                                                      
CONECT   46   40                                                      
CONECT   47   40                                                      
CONECT   48   41                                                      
CONECT   49   41                                                      
CONECT   50   42                                                      
CONECT   51   42                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
