COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.612  -2.299   0.512  1.00  0.00           O  
HETATM    2  C   UNL     1       4.006  -1.318  -0.087  1.00  0.00           C  
HETATM    3  N   UNL     1       5.239  -1.310  -0.632  1.00  0.00           N  
HETATM    4  C   UNL     1       3.132  -0.136  -0.223  1.00  0.00           C  
HETATM    5  C   UNL     1       1.849  -0.138   0.335  1.00  0.00           C  
HETATM    6  C   UNL     1       1.067   0.997   0.181  1.00  0.00           C  
HETATM    7  C   UNL     1       3.580   1.001  -0.906  1.00  0.00           C  
HETATM    8  N   UNL     1       2.816   2.060  -1.035  1.00  0.00           N  
HETATM    9  C   UNL     1       1.585   2.101  -0.525  1.00  0.00           C  
HETATM   10  C   UNL     1       0.571   3.093  -0.517  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.484   2.601   0.156  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.207   1.335   0.586  1.00  0.00           N  
HETATM   13  S   UNL     1      -1.232   0.366   1.454  1.00  0.00           S  
HETATM   14  O   UNL     1      -0.477  -0.141   2.546  1.00  0.00           O  
HETATM   15  O   UNL     1      -2.437   1.100   1.617  1.00  0.00           O  
HETATM   16  C   UNL     1      -1.626  -1.018   0.437  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.358  -0.838  -0.722  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.811   0.517  -1.108  1.00  0.00           N1+
HETATM   19  O   UNL     1      -3.556   0.662  -2.061  1.00  0.00           O1-
HETATM   20  O   UNL     1      -2.440   1.488  -0.473  1.00  0.00           O  
HETATM   21  C   UNL     1      -1.198  -2.283   0.795  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.507  -3.368  -0.003  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.245  -3.190  -1.158  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.667  -1.924  -1.520  1.00  0.00           C  
HETATM   25  H   UNL     1       5.811  -2.088  -0.547  1.00  0.00           H  
HETATM   26  H   UNL     1       5.553  -0.527  -1.110  1.00  0.00           H  
HETATM   27  H   UNL     1       1.478  -0.999   0.871  1.00  0.00           H  
HETATM   28  H   UNL     1       4.572   1.007  -1.334  1.00  0.00           H  
HETATM   29  H   UNL     1       0.635   4.071  -0.970  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.411   3.128   0.329  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.622  -2.422   1.697  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.239  -1.783  -2.425  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.173  -4.357   0.276  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.486  -4.038  -1.782  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   25   26                                            
CONECT    4    2    5    7    7                                       
CONECT    5    4    6    6   27                                       
CONECT    6    5    5    9   12                                       
CONECT    7    4    4    8   28                                       
CONECT    8    7    9    9                                            
CONECT    9    6    8    8   10                                       
CONECT   10    9   11   11   29                                       
CONECT   11   10   10   12   30                                       
CONECT   12    6   11   13                                            
CONECT   13   12   14   14   15                                       
CONECT   13   15   16                                                 
CONECT   14   13   13                                                 
CONECT   15   13   13                                                 
CONECT   16   13   17   21   21                                       
CONECT   17   16   18   24   24                                       
CONECT   18   17   19   20   20                                       
CONECT   19   18                                                      
CONECT   20   18   18                                                 
CONECT   21   16   16   22   31                                       
CONECT   22   21   23   23   33                                       
CONECT   23   22   22   24   34                                       
CONECT   24   17   17   23   32                                       
CONECT   25    3                                                      
CONECT   26    3                                                      
CONECT   27    5                                                      
CONECT   28    7                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   21                                                      
CONECT   32   24                                                      
CONECT   33   22                                                      
CONECT   34   23                                                      
MASTER        0    0    0    0    0    0    0    0   34    0   34    0
END
