COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.315   2.072   0.104  1.00  0.00           C  
HETATM    2  N   UNL     1       3.121   4.629   0.226  1.00  0.00           N  
HETATM    3  C   UNL     1       1.698  -2.408  -0.099  1.00  0.00           C  
HETATM    4  C   UNL     1       1.248  -1.155  -0.037  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.983  -1.212   1.070  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.765  -0.114  -1.073  1.00  0.00           C  
HETATM    7  C   UNL     1       3.207   3.498   0.172  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.194  -0.821  -0.013  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.121   1.731  -0.182  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.626  -0.556   0.340  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.769   1.432  -0.205  1.00  0.00           C  
HETATM   12  C   UNL     1       2.299  -0.139   0.005  1.00  0.00           C  
HETATM   13  C   UNL     1       3.565  -0.694  -0.028  1.00  0.00           C  
HETATM   14  N   UNL     1       4.683   0.114   0.016  1.00  0.00           N  
HETATM   15  C   UNL     1       4.586   1.451   0.074  1.00  0.00           C  
HETATM   16  C   UNL     1       2.167   1.276   0.073  1.00  0.00           C  
HETATM   17  S   UNL     1       3.450  -2.449  -0.110  1.00  0.00           S  
HETATM   18  C   UNL     1      -2.326  -0.906   1.089  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.897  -0.205   0.027  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.108   0.187  -1.055  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.342   0.124   0.048  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.282  -0.868   0.321  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.045   0.740   0.094  1.00  0.00           C  
HETATM   24  O   UNL     1      -3.860   2.406  -0.472  1.00  0.00           O  
HETATM   25  O   UNL     1       0.942   1.846   0.106  1.00  0.00           O  
HETATM   26  O   UNL     1       5.596   2.133   0.101  1.00  0.00           O  
HETATM   27 CL   UNL     1       0.683  -3.814  -0.159  1.00  0.00          Cl  
HETATM   28  H   UNL     1      -0.542  -1.759   1.890  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.154   0.189  -1.911  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.455   2.739  -0.377  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.354  -1.326   0.551  1.00  0.00           H  
HETATM   32  H   UNL     1       5.562  -0.296  -0.004  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.936  -1.208   1.927  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.551   0.730  -1.877  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.959  -1.880   0.513  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.098   0.977   0.110  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.542   2.873   0.313  1.00  0.00           H  
HETATM   38  H   UNL     1       0.958   2.812   0.152  1.00  0.00           H  
CONECT    1   15   16   16    7                                       
CONECT    2    7    7    7                                            
CONECT    3   17   27    4    4                                       
CONECT    4    3    3   12    8                                       
CONECT    5   18   18    8   28                                       
CONECT    6    8    8   20   29                                       
CONECT    7    1    2    2    2                                       
CONECT    8    5    4    6    6                                       
CONECT    9   23   23   11   30                                       
CONECT   10   22   22   23   31                                       
CONECT   11   21   21    9   24                                       
CONECT   12   13   13    4   16                                       
CONECT   13   17   14   12   12                                       
CONECT   14   15   13   32                                            
CONECT   15   26   26   14    1                                       
CONECT   16   12    1    1   25                                       
CONECT   17   13    3                                                 
CONECT   18    5    5   19   33                                       
CONECT   19   18   21   20   20                                       
CONECT   20   19   19    6   34                                       
CONECT   21   22   19   11   11                                       
CONECT   22   10   10   21   35                                       
CONECT   23   10    9    9   36                                       
CONECT   24   11   37                                                 
CONECT   25   16   38                                                 
CONECT   26   15   15                                                 
CONECT   27    3                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    9                                                      
CONECT   31   10                                                      
CONECT   32   14                                                      
CONECT   33   18                                                      
CONECT   34   20                                                      
CONECT   35   22                                                      
CONECT   36   23                                                      
CONECT   37   24                                                      
CONECT   38   25                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
