COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.775   0.350  -0.301  1.00  0.00           C  
HETATM    2  C   UNL     1       7.149   0.338   0.040  1.00  0.00           C  
HETATM    3  C   UNL     1       4.808  -1.012  -0.569  1.00  0.00           C  
HETATM    4  C   UNL     1       0.120   0.021   1.789  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.299   0.807  -0.009  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.381  -0.238   0.269  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.751   0.336  -0.097  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.833  -0.710   0.181  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.182  -0.144  -0.179  1.00  0.00           C  
HETATM   10  C   UNL     1       1.098   1.133  -0.127  1.00  0.00           C  
HETATM   11  C   UNL     1       2.420   0.427   0.028  1.00  0.00           C  
HETATM   12  C   UNL     1       5.951   1.024   0.001  1.00  0.00           C  
HETATM   13  C   UNL     1       7.178  -1.020  -0.222  1.00  0.00           C  
HETATM   14  C   UNL     1       6.009  -1.693  -0.529  1.00  0.00           C  
HETATM   15  N   UNL     1       0.017   0.256   0.343  1.00  0.00           N  
HETATM   16  N   UNL     1      -7.292  -0.892  -0.018  1.00  0.00           N  
HETATM   17  N   UNL     1       3.560   1.044  -0.341  1.00  0.00           N  
HETATM   18  O   UNL     1      -6.270   0.984  -0.615  1.00  0.00           O  
HETATM   19  O   UNL     1      -8.560  -0.360  -0.356  1.00  0.00           O  
HETATM   20  O   UNL     1       2.459  -0.696   0.485  1.00  0.00           O  
HETATM   21  H   UNL     1       8.064   0.861   0.274  1.00  0.00           H  
HETATM   22  H   UNL     1       3.896  -1.538  -0.807  1.00  0.00           H  
HETATM   23  H   UNL     1       0.053   0.972   2.317  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.692  -0.631   2.111  1.00  0.00           H  
HETATM   25  H   UNL     1       1.076  -0.452   2.013  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.311   1.071  -1.066  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.491   1.697   0.591  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.188  -1.128  -0.330  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.368  -0.503   1.327  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.943   1.226   0.502  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.763   0.600  -1.154  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.640  -1.600  -0.418  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.820  -0.974   1.238  1.00  0.00           H  
HETATM   34  H   UNL     1       1.104   2.049   0.462  1.00  0.00           H  
HETATM   35  H   UNL     1       0.937   1.377  -1.177  1.00  0.00           H  
HETATM   36  H   UNL     1       5.930   2.085   0.206  1.00  0.00           H  
HETATM   37  H   UNL     1       8.116  -1.555  -0.192  1.00  0.00           H  
HETATM   38  H   UNL     1       6.035  -2.753  -0.733  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.221  -1.794   0.331  1.00  0.00           H  
HETATM   40  H   UNL     1       3.539   1.968  -0.634  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.295  -0.970  -0.205  1.00  0.00           H  
CONECT    1   12   17    3    3                                       
CONECT    2   12   12   13   21                                       
CONECT    3    1    1   14   22                                       
CONECT    4   15   23   24   25                                       
CONECT    5    6   15   26   27                                       
CONECT    6    7    5   28   29                                       
CONECT    7    8    6   30   31                                       
CONECT    8    9    7   32   33                                       
CONECT    9   18   18    8   16                                       
CONECT   10   11   15   34   35                                       
CONECT   11   17   10   20   20                                       
CONECT   12    2    2    1   36                                       
CONECT   13    2   14   14   37                                       
CONECT   14   13   13    3   38                                       
CONECT   15    4   10    5                                            
CONECT   16    9   19   39                                            
CONECT   17    1   11   40                                            
CONECT   18    9    9                                                 
CONECT   19   16   41                                                 
CONECT   20   11   11                                                 
CONECT   21    2                                                      
CONECT   22    3                                                      
CONECT   23    4                                                      
CONECT   24    4                                                      
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   19                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
