COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNK A   1       2.150   3.334  -5.276  1.00  0.00           O  
HETATM    2  C   UNK A   1       2.807   3.503  -4.098  1.00  0.00           C  
HETATM    3  O   UNK A   1       4.024   3.438  -4.000  1.00  0.00           O  
HETATM    4  C   UNK A   1       1.841   3.771  -2.963  1.00  0.00           C  
HETATM    5  C   UNK A   1       2.530   3.876  -1.604  1.00  0.00           C  
HETATM    6  C   UNK A   1       1.521   4.091  -0.499  1.00  0.00           C  
HETATM    7  C   UNK A   1       1.251   5.509  -0.095  1.00  0.00           C  
HETATM    8  O   UNK A   1       0.384   6.180  -0.616  1.00  0.00           O  
HETATM    9  O   UNK A   1       2.076   5.850   0.904  1.00  0.00           O  
HETATM   10  N   UNK A   1       0.833   3.186   0.121  1.00  0.00           N  
HETATM   11  O   UNK A   1       1.147   1.906  -0.351  1.00  0.00           O  
HETATM   12  C   UNK A   1       0.364   0.965   0.366  1.00  0.00           C  
HETATM   13  C   UNK A   1       0.687  -0.436  -0.130  1.00  0.00           C  
HETATM   14  C   UNK A   1       0.353  -0.571  -1.601  1.00  0.00           C  
HETATM   15  O   UNK A   1       1.100  -0.271  -2.523  1.00  0.00           O  
HETATM   16  N   UNK A   1       2.088  -0.745   0.023  1.00  0.00           N  
HETATM   17  C   UNK A   0       2.612  -1.357   1.152  1.00  0.00           C  
HETATM   18  O   UNK A   0       1.968  -1.706   2.138  1.00  0.00           O  
HETATM   19  C   UNK A   0       4.108  -1.559   1.038  1.00  0.00           C  
HETATM   20  O   UNK A   0       4.615  -2.196   2.192  1.00  0.00           O  
HETATM   21  C   UNK A   0       5.910  -1.906   2.551  1.00  0.00           C  
HETATM   22  C   UNK A   0       6.834  -1.577   1.569  1.00  0.00           C  
HETATM   23  C   UNK A   0       8.148  -1.283   1.934  1.00  0.00           C  
HETATM   24  C   UNK A   0       8.524  -1.321   3.277  1.00  0.00           C  
HETATM   25  C   UNK A   0       7.587  -1.652   4.255  1.00  0.00           C  
HETATM   26  C   UNK A   0       6.273  -1.946   3.890  1.00  0.00           C  
HETATM   27  O   UNK A   1      -0.913  -1.024  -1.794  1.00  0.00           O  
HETATM   28  H   UNK A   1       2.726   3.156  -6.050  1.00  0.00           H  
HETATM   29  H   UNK A   1       1.281   4.684  -3.194  1.00  0.00           H  
HETATM   30  H   UNK A   1       1.145   2.925  -2.933  1.00  0.00           H  
HETATM   31  H   UNK A   1       3.277   4.677  -1.586  1.00  0.00           H  
HETATM   32  H   UNK A   1       3.070   2.946  -1.396  1.00  0.00           H  
HETATM   33  H   UNK A   1       1.920   6.766   1.219  1.00  0.00           H  
HETATM   34  H   UNK A   1       0.602   1.071   1.429  1.00  0.00           H  
HETATM   35  H   UNK A   1      -0.695   1.209   0.223  1.00  0.00           H  
HETATM   36  H   UNK A   1       0.158  -1.203   0.446  1.00  0.00           H  
HETATM   37  H   UNK A   1       2.722  -0.501  -0.734  1.00  0.00           H  
HETATM   38  H   UNK A   1      -1.192  -1.097  -2.732  1.00  0.00           H  
HETATM   39  H   UNK A   0       4.322  -2.191   0.171  1.00  0.00           H  
HETATM   40  H   UNK A   0       4.609  -0.594   0.909  1.00  0.00           H  
HETATM   41  H   UNK A   0       6.547  -1.546   0.522  1.00  0.00           H  
HETATM   42  H   UNK A   0       5.547  -2.204   4.657  1.00  0.00           H  
HETATM   43  H   UNK A   0       8.878  -1.025   1.173  1.00  0.00           H  
HETATM   44  H   UNK A   0       9.548  -1.091   3.560  1.00  0.00           H  
HETATM   45  H   UNK A   0       7.880  -1.681   5.300  1.00  0.00           H  
CONECT    1    2   28                                                 
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   29   30                                       
CONECT    5    4    6   31   32                                       
CONECT    6    5    7   10   10                                       
CONECT    7    6    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   33                                                 
CONECT   10    6    6   11                                            
CONECT   11   10   12                                                 
CONECT   12   11   13   34   35                                       
CONECT   13   12   14   16   36                                       
CONECT   14   13   15   15   27                                       
CONECT   15   14   14                                                 
CONECT   16   13   17   37                                            
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   39   40                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   26   26                                       
CONECT   22   21   23   23   41                                       
CONECT   23   22   22   24   43                                       
CONECT   24   23   25   25   44                                       
CONECT   25   24   24   26   45                                       
CONECT   26   21   21   25   42                                       
CONECT   27   14   38                                                 
CONECT   28    1                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    9                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   16                                                      
CONECT   38   27                                                      
CONECT   39   19                                                      
CONECT   40   19                                                      
CONECT   41   22                                                      
CONECT   42   26                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
