COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.137   0.750   0.109  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.213   1.590   0.164  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.506   1.081   0.013  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.668   1.988   0.073  1.00  0.00           C  
HETATM    5  O   UNL     1      -5.501   3.178   0.254  1.00  0.00           O  
HETATM    6  O   UNL     1      -6.914   1.497  -0.074  1.00  0.00           O  
HETATM    7  C   UNL     1      -4.698  -0.289  -0.196  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.622  -1.129  -0.252  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.328  -0.618  -0.105  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.168  -1.524  -0.165  1.00  0.00           C  
HETATM   11  N   UNL     1       0.033  -1.051  -0.029  1.00  0.00           N  
HETATM   12  N   UNL     1       1.129  -1.922   0.019  1.00  0.00           N  
HETATM   13  C   UNL     1       1.066  -3.269   0.051  1.00  0.00           C  
HETATM   14  S   UNL     1      -0.361  -4.214   0.038  1.00  0.00           S  
HETATM   15  N   UNL     1       2.331  -3.736   0.092  1.00  0.00           N  
HETATM   16  N   UNL     1       3.191  -2.629   0.086  1.00  0.00           N  
HETATM   17  C   UNL     1       2.460  -1.550   0.037  1.00  0.00           C  
HETATM   18  C   UNL     1       2.970  -0.162   0.013  1.00  0.00           C  
HETATM   19  C   UNL     1       2.079   0.911  -0.035  1.00  0.00           C  
HETATM   20  C   UNL     1       2.560   2.203  -0.057  1.00  0.00           C  
HETATM   21  C   UNL     1       3.924   2.438  -0.032  1.00  0.00           C  
HETATM   22 CL   UNL     1       4.523   4.067  -0.061  1.00  0.00          Cl  
HETATM   23  C   UNL     1       4.814   1.377   0.015  1.00  0.00           C  
HETATM   24  C   UNL     1       4.344   0.080   0.044  1.00  0.00           C  
HETATM   25  H   UNL     1      -1.138   1.144   0.226  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.064   2.648   0.326  1.00  0.00           H  
HETATM   27  H   UNL     1      -7.643   2.130  -0.027  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.697  -0.682  -0.313  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.771  -2.186  -0.413  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.317  -2.582  -0.322  1.00  0.00           H  
HETATM   31  H   UNL     1       2.597  -4.668   0.122  1.00  0.00           H  
HETATM   32  H   UNL     1       1.015   0.729  -0.055  1.00  0.00           H  
HETATM   33  H   UNL     1       1.871   3.034  -0.094  1.00  0.00           H  
HETATM   34  H   UNL     1       5.877   1.566   0.034  1.00  0.00           H  
HETATM   35  H   UNL     1       5.038  -0.746   0.086  1.00  0.00           H  
CONECT    1    9    2    2   25                                       
CONECT    2    1    1    3   26                                       
CONECT    3    7    7    2    4                                       
CONECT    4    3    5    5    6                                       
CONECT    5    4    4                                                 
CONECT    6    4   27                                                 
CONECT    7    8    3    3   28                                       
CONECT    8    9    9    7   29                                       
CONECT    9   10    8    8    1                                       
CONECT   10   11   11    9   30                                       
CONECT   11   12   10   10                                            
CONECT   12   17   13   11                                            
CONECT   13   15   12   14   14                                       
CONECT   14   13   13                                                 
CONECT   15   16   13   31                                            
CONECT   16   15   17   17                                            
CONECT   17   16   16   18   12                                       
CONECT   18   19   17   24   24                                       
CONECT   19   20   20   18   32                                       
CONECT   20   19   19   21   33                                       
CONECT   21   20   22   23   23                                       
CONECT   22   21                                                      
CONECT   23   21   21   24   34                                       
CONECT   24   18   18   23   35                                       
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30   10                                                      
CONECT   31   15                                                      
CONECT   32   19                                                      
CONECT   33   20                                                      
CONECT   34   23                                                      
CONECT   35   24                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
