COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.520  -2.490  -0.284  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.377   1.138  -0.209  1.00  0.00           C  
HETATM    3  O   UNL     1      -4.782   2.194  -1.359  1.00  0.00           O  
HETATM    4  C   UNL     1       0.909   1.944  -0.019  1.00  0.00           C  
HETATM    5  C   UNL     1       2.114   1.003  -0.080  1.00  0.00           C  
HETATM    6  C   UNL     1       4.897   0.728   0.047  1.00  0.00           C  
HETATM    7  C   UNL     1       6.233   1.086   0.177  1.00  0.00           C  
HETATM    8  C   UNL     1       4.553  -0.603  -0.155  1.00  0.00           C  
HETATM    9  C   UNL     1       7.216   0.118   0.105  1.00  0.00           C  
HETATM   10  C   UNL     1       5.540  -1.566  -0.227  1.00  0.00           C  
HETATM   11  C   UNL     1       6.871  -1.207  -0.097  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.418  -0.888   0.535  1.00  0.00           C  
HETATM   13  S   UNL     1      -3.079   0.133   1.056  1.00  0.00           S  
HETATM   14  C   UNL     1      -4.964  -1.821   1.408  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.927  -0.765  -0.752  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.869   1.273  -0.339  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.013  -2.618   0.997  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.976  -1.566  -1.158  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.582   2.079  -0.148  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.045   2.213  -0.402  1.00  0.00           C  
HETATM   21  O   UNL     1      -4.275   3.070   0.606  1.00  0.00           O  
HETATM   22  C   UNL     1      -7.665  -3.363  -0.730  1.00  0.00           C  
HETATM   23  S   UNL     1       3.640   1.959   0.146  1.00  0.00           S  
HETATM   24 CL   UNL     1       8.109  -2.420  -0.188  1.00  0.00          Cl  
HETATM   25  H   UNL     1      -0.354   0.640  -1.179  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.459   0.392   0.581  1.00  0.00           H  
HETATM   27  H   UNL     1       0.991   2.691  -0.809  1.00  0.00           H  
HETATM   28  H   UNL     1       0.886   2.443   0.950  1.00  0.00           H  
HETATM   29  H   UNL     1       2.033   0.257   0.710  1.00  0.00           H  
HETATM   30  H   UNL     1       2.138   0.505  -1.049  1.00  0.00           H  
HETATM   31  H   UNL     1       6.503   2.120   0.334  1.00  0.00           H  
HETATM   32  H   UNL     1       3.515  -0.884  -0.256  1.00  0.00           H  
HETATM   33  H   UNL     1       8.254   0.396   0.206  1.00  0.00           H  
HETATM   34  H   UNL     1       5.274  -2.601  -0.383  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.571  -1.919   2.410  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.505  -0.041  -1.434  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.807   0.705  -1.267  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.438  -3.343   1.675  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.372  -1.472  -2.158  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.605   2.577   0.821  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.501   2.825  -0.939  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.041   3.652   0.520  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.609  -2.869  -0.502  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.594  -3.534  -1.804  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.619  -4.318  -0.206  1.00  0.00           H  
CONECT    1   17   17   18   22                                       
CONECT    2   19    4   25   26                                       
CONECT    3   20   20                                                 
CONECT    4    2    5   27   28                                       
CONECT    5    4   23   29   30                                       
CONECT    6   23    7    7    8                                       
CONECT    7    6    6    9   31                                       
CONECT    8    6   10   10   32                                       
CONECT    9    7   11   11   33                                       
CONECT   10    8    8   11   34                                       
CONECT   11    9    9   10   24                                       
CONECT   12   13   14   14   15                                       
CONECT   13   12   16                                                 
CONECT   14   12   12   17   35                                       
CONECT   15   12   18   18   36                                       
CONECT   16   13   19   20   37                                       
CONECT   17   14    1    1   38                                       
CONECT   18   15   15    1   39                                       
CONECT   19   16    2   40   41                                       
CONECT   20   16    3    3   21                                       
CONECT   21   20   42                                                 
CONECT   22    1   43   44   45                                       
CONECT   23    5    6                                                 
CONECT   24   11                                                      
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
