COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.949   0.480   1.227  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.696  -0.219   0.036  1.00  0.00           C  
HETATM    3  S   UNL     1      -1.613  -1.609   0.050  1.00  0.00           S  
HETATM    4  O   UNL     1      -1.687  -2.143   1.365  1.00  0.00           O  
HETATM    5  O   UNL     1      -1.889  -2.326  -1.145  1.00  0.00           O  
HETATM    6  C   UNL     1       0.030  -0.998  -0.126  1.00  0.00           C  
HETATM    7  O   UNL     1       0.660  -0.811  -1.299  1.00  0.00           O  
HETATM    8  C   UNL     1       1.906  -0.334  -1.105  1.00  0.00           C  
HETATM    9  C   UNL     1       2.940   0.013  -1.966  1.00  0.00           C  
HETATM   10  C   UNL     1       4.131   0.484  -1.456  1.00  0.00           C  
HETATM   11  C   UNL     1       4.313   0.617  -0.087  1.00  0.00           C  
HETATM   12 CL   UNL     1       5.822   1.211   0.532  1.00  0.00          Cl  
HETATM   13  C   UNL     1       3.299   0.278   0.784  1.00  0.00           C  
HETATM   14  C   UNL     1       2.090  -0.199   0.281  1.00  0.00           C  
HETATM   15  C   UNL     1       0.830  -0.644   0.889  1.00  0.00           C  
HETATM   16  C   UNL     1       0.504  -0.697   2.359  1.00  0.00           C  
HETATM   17  N   UNL     1      -3.262   0.149  -1.080  1.00  0.00           N  
HETATM   18  N   UNL     1      -4.059   1.153  -1.149  1.00  0.00           N  
HETATM   19  C   UNL     1      -4.362   1.892  -0.065  1.00  0.00           C  
HETATM   20  O   UNL     1      -5.124   2.841  -0.158  1.00  0.00           O  
HETATM   21  C   UNL     1      -3.790   1.556   1.181  1.00  0.00           C  
HETATM   22  H   UNL     1      -2.485   0.180   2.155  1.00  0.00           H  
HETATM   23  H   UNL     1       2.810  -0.086  -3.033  1.00  0.00           H  
HETATM   24  H   UNL     1       4.932   0.752  -2.130  1.00  0.00           H  
HETATM   25  H   UNL     1       3.441   0.382   1.850  1.00  0.00           H  
HETATM   26  H   UNL     1       0.064   0.251   2.668  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.205  -1.504   2.545  1.00  0.00           H  
HETATM   28  H   UNL     1       1.416  -0.877   2.927  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.454   1.385  -2.005  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.012   2.129   2.070  1.00  0.00           H  
CONECT    1    2   21   21   22                                       
CONECT    2    1    3   17   17                                       
CONECT    3    2    4    4    5                                       
CONECT    3    5    6                                                 
CONECT    4    3    3                                                 
CONECT    5    3    3                                                 
CONECT    6    3    7   15   15                                       
CONECT    7    6    8                                                 
CONECT    8    7    9    9   14                                       
CONECT    9    8    8   10   23                                       
CONECT   10    9   11   11   24                                       
CONECT   11   10   10   12   13                                       
CONECT   12   11                                                      
CONECT   13   11   14   14   25                                       
CONECT   14    8   13   13   15                                       
CONECT   15    6    6   14   16                                       
CONECT   16   15   26   27   28                                       
CONECT   17    2    2   18                                            
CONECT   18   17   19   29                                            
CONECT   19   18   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21    1    1   19   30                                       
CONECT   22    1                                                      
CONECT   23    9                                                      
CONECT   24   10                                                      
CONECT   25   13                                                      
CONECT   26   16                                                      
CONECT   27   16                                                      
CONECT   28   16                                                      
CONECT   29   18                                                      
CONECT   30   21                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
