COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -1.617  -1.888   0.266  1.00  0.00           O  
HETATM    2  C   UNL     1       0.897  -0.915   0.352  1.00  0.00           C  
HETATM    3  C   UNL     1       1.327  -1.386  -1.039  1.00  0.00           C  
HETATM    4  C   UNL     1       4.467   0.835  -0.853  1.00  0.00           C  
HETATM    5  N   UNL     1       4.114  -0.356  -1.159  1.00  0.00           N  
HETATM    6  C   UNL     1       2.583  -2.251  -0.918  1.00  0.00           C  
HETATM    7  C   UNL     1       3.708  -1.431  -0.283  1.00  0.00           C  
HETATM    8  C   UNL     1       3.281  -0.948   1.097  1.00  0.00           C  
HETATM    9  C   UNL     1       4.409  -0.107   1.709  1.00  0.00           C  
HETATM   10  N   UNL     1       4.842   1.681  -1.870  1.00  0.00           N  
HETATM   11  S   UNL     1       4.502   1.455   0.793  1.00  0.00           S  
HETATM   12  N   UNL     1      -0.310  -0.093   0.237  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.524  -0.678   0.203  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.742   0.152   0.087  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.000  -0.451   0.051  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.133   0.330  -0.056  1.00  0.00           C  
HETATM   17 CL   UNL     1      -6.700  -0.417  -0.101  1.00  0.00          Cl  
HETATM   18  C   UNL     1      -5.023   1.709  -0.127  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.778   2.312  -0.092  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.639   1.542   0.020  1.00  0.00           C  
HETATM   21  C   UNL     1       2.020  -0.088   0.979  1.00  0.00           C  
HETATM   22  H   UNL     1       0.688  -1.781   0.980  1.00  0.00           H  
HETATM   23  H   UNL     1       0.525  -1.971  -1.489  1.00  0.00           H  
HETATM   24  H   UNL     1       1.541  -0.520  -1.666  1.00  0.00           H  
HETATM   25  H   UNL     1       2.369  -3.118  -0.294  1.00  0.00           H  
HETATM   26  H   UNL     1       2.892  -2.584  -1.909  1.00  0.00           H  
HETATM   27  H   UNL     1       4.569  -2.087  -0.156  1.00  0.00           H  
HETATM   28  H   UNL     1       3.079  -1.806   1.737  1.00  0.00           H  
HETATM   29  H   UNL     1       4.192   0.094   2.758  1.00  0.00           H  
HETATM   30  H   UNL     1       5.355  -0.641   1.623  1.00  0.00           H  
HETATM   31  H   UNL     1       5.115   2.590  -1.670  1.00  0.00           H  
HETATM   32  H   UNL     1       4.834   1.369  -2.789  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.236   0.873   0.187  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.087  -1.526   0.107  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.912   2.316  -0.211  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.699   3.387  -0.147  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.668   2.015   0.048  1.00  0.00           H  
HETATM   38  H   UNL     1       2.229   0.778   0.350  1.00  0.00           H  
HETATM   39  H   UNL     1       1.715   0.247   1.970  1.00  0.00           H  
CONECT    1   13   13                                                 
CONECT    2    3   12   21   22                                       
CONECT    3    6    2   23   24                                       
CONECT    4    5    5   11   10                                       
CONECT    5    7    4    4                                            
CONECT    6    3    7   25   26                                       
CONECT    7    6    8    5   27                                       
CONECT    8    7   21    9   28                                       
CONECT    9    8   11   29   30                                       
CONECT   10    4   31   32                                            
CONECT   11    9    4                                                 
CONECT   12   13    2   33                                            
CONECT   13    1    1   14   12                                       
CONECT   14   20   13   15   15                                       
CONECT   15   14   14   16   34                                       
CONECT   16   18   18   15   17                                       
CONECT   17   16                                                      
CONECT   18   19   16   16   35                                       
CONECT   19   20   20   18   36                                       
CONECT   20   19   19   14   37                                       
CONECT   21    2    8   38   39                                       
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    3                                                      
CONECT   25    6                                                      
CONECT   26    6                                                      
CONECT   27    7                                                      
CONECT   28    8                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   10                                                      
CONECT   33   12                                                      
CONECT   34   15                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
CONECT   39   21                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
