COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   1      -1.899   2.010   0.378  1.00  0.00           C  
HETATM    2  C   UNK A   1      -2.415   0.686  -0.190  1.00  0.00           C  
HETATM    3  C   UNK A   1      -3.792   0.379   0.402  1.00  0.00           C  
HETATM    4  C   UNK A   1      -0.068   3.677   0.249  1.00  0.00           C  
HETATM    5  C   UNK A   1      -0.522   2.317  -0.214  1.00  0.00           C  
HETATM    6  C   UNK A   1      -4.308  -0.945  -0.166  1.00  0.00           C  
HETATM    7  C   UNK A   1      -6.292  -2.385   0.035  1.00  0.00           C  
HETATM    8  N   UNK A   1       0.438   1.304   0.232  1.00  0.00           N  
HETATM    9  N   UNK A   1      -5.627  -1.238   0.401  1.00  0.00           N  
HETATM   10  N   UNK A   1      -7.530  -2.660   0.567  1.00  0.00           N  
HETATM   11  N   UNK A   1      -5.749  -3.210  -0.816  1.00  0.00           N  
HETATM   12  O   UNK A   1       0.952   3.789   0.886  1.00  0.00           O  
HETATM   13  O   UNK A   1      -0.798   4.765  -0.046  1.00  0.00           O  
HETATM   14  H   UNK A   1      -2.592   2.810   0.119  1.00  0.00           H  
HETATM   15  H   UNK A   1      -1.820   1.934   1.462  1.00  0.00           H  
HETATM   16  H   UNK A   1      -2.494   0.762  -1.274  1.00  0.00           H  
HETATM   17  H   UNK A   1      -1.722  -0.115   0.069  1.00  0.00           H  
HETATM   18  H   UNK A   1      -3.713   0.303   1.486  1.00  0.00           H  
HETATM   19  H   UNK A   1      -4.485   1.180   0.143  1.00  0.00           H  
HETATM   20  H   UNK A   1      -0.583   2.305  -1.302  1.00  0.00           H  
HETATM   21  H   UNK A   1      -4.387  -0.869  -1.250  1.00  0.00           H  
HETATM   22  H   UNK A   1      -3.615  -1.745   0.093  1.00  0.00           H  
HETATM   23  H   UNK A   1       0.282   0.819   1.058  1.00  0.00           H  
HETATM   24  H   UNK A   1      -6.030  -0.624   1.034  1.00  0.00           H  
HETATM   25  H   UNK A   1      -7.933  -2.046   1.200  1.00  0.00           H  
HETATM   26  H   UNK A   1      -7.999  -3.469   0.309  1.00  0.00           H  
HETATM   27  H   UNK A   1      -4.876  -3.015  -1.191  1.00  0.00           H  
HETATM   28  H   UNK A   1      -0.466   5.615   0.272  1.00  0.00           H  
HETATM   29  C   UNK A   0       1.536   1.045  -0.504  1.00  0.00           C  
HETATM   30  O   UNK A   0       1.730   1.653  -1.539  1.00  0.00           O  
HETATM   31  O   UNK A   0       2.418   0.115  -0.094  1.00  0.00           O  
HETATM   32  C   UNK A   0       3.578  -0.111  -0.938  1.00  0.00           C  
HETATM   33  C   UNK A   0       4.446  -1.179  -0.324  1.00  0.00           C  
HETATM   34  C   UNK A   0       4.240  -2.507  -0.647  1.00  0.00           C  
HETATM   35  C   UNK A   0       5.036  -3.487  -0.084  1.00  0.00           C  
HETATM   36  C   UNK A   0       6.038  -3.139   0.803  1.00  0.00           C  
HETATM   37  C   UNK A   0       6.244  -1.811   1.126  1.00  0.00           C  
HETATM   38  C   UNK A   0       5.451  -0.831   0.559  1.00  0.00           C  
HETATM   39  H   UNK A   0       3.251  -0.433  -1.927  1.00  0.00           H  
HETATM   40  H   UNK A   0       4.148   0.813  -1.027  1.00  0.00           H  
HETATM   41  H   UNK A   0       3.458  -2.780  -1.340  1.00  0.00           H  
HETATM   42  H   UNK A   0       4.875  -4.525  -0.336  1.00  0.00           H  
HETATM   43  H   UNK A   0       6.659  -3.904   1.244  1.00  0.00           H  
HETATM   44  H   UNK A   0       7.026  -1.538   1.819  1.00  0.00           H  
HETATM   45  H   UNK A   0       5.612   0.207   0.812  1.00  0.00           H  
CONECT    1    2    5   14   15                                       
CONECT    2    3    1   16   17                                       
CONECT    3    6    2   18   19                                       
CONECT    4   12   12    5   13                                       
CONECT    5    1    4    8   20                                       
CONECT    6    9    3   21   22                                       
CONECT    7   11   11   10    9                                       
CONECT    8    5   23   29                                            
CONECT    9    7    6   24                                            
CONECT   10    7   25   26                                            
CONECT   11    7    7   27                                            
CONECT   12    4    4                                                 
CONECT   13    4   28                                                 
CONECT   14    1                                                      
CONECT   15    1                                                      
CONECT   16    2                                                      
CONECT   17    2                                                      
CONECT   18    3                                                      
CONECT   19    3                                                      
CONECT   20    5                                                      
CONECT   21    6                                                      
CONECT   22    6                                                      
CONECT   23    8                                                      
CONECT   24    9                                                      
CONECT   25   10                                                      
CONECT   26   10                                                      
CONECT   27   11                                                      
CONECT   28   13                                                      
CONECT   29    8   30   30   31                                       
CONECT   30   29   29                                                 
CONECT   31   29   32                                                 
CONECT   32   31   33   39   40                                       
CONECT   33   32   34   38   38                                       
CONECT   34   33   35   35   41                                       
CONECT   35   34   34   36   42                                       
CONECT   36   35   37   37   43                                       
CONECT   37   36   36   38   44                                       
CONECT   38   37   33   33   45                                       
CONECT   39   32                                                      
CONECT   40   32                                                      
CONECT   41   34                                                      
CONECT   42   35                                                      
CONECT   43   36                                                      
CONECT   44   37                                                      
CONECT   45   38                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
