COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.720   0.106   0.058  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.049  -0.804   0.864  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.676  -0.744   0.978  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.809  -0.614   1.214  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.726   0.420   0.627  1.00  0.00           C  
HETATM    6  C   UNL     1       3.357  -1.884  -1.480  1.00  0.00           C  
HETATM    7  C   UNL     1       2.930  -0.970  -0.538  1.00  0.00           C  
HETATM    8  C   UNL     1       3.928  -0.304   0.374  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.962   0.231   0.283  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.772   1.274  -0.291  1.00  0.00           C  
HETATM   11  C   UNL     1       2.442  -2.496  -2.317  1.00  0.00           C  
HETATM   12  C   UNL     1       4.647  -1.352   1.184  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.012   1.079  -0.635  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.639   1.143  -0.525  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.398   1.327  -0.186  1.00  0.00           C  
HETATM   16  C   UNL     1      -9.699   1.008  -0.903  1.00  0.00           C  
HETATM   17  C   UNL     1       1.578  -0.665  -0.431  1.00  0.00           C  
HETATM   18  C   UNL     1       0.661  -1.281  -1.274  1.00  0.00           C  
HETATM   19  C   UNL     1       1.096  -2.199  -2.211  1.00  0.00           C  
HETATM   20  C   UNL     1       4.942   0.477  -0.464  1.00  0.00           C  
HETATM   21  C   UNL     1       5.879   1.254   0.462  1.00  0.00           C  
HETATM   22  C   UNL     1       6.878   2.023  -0.363  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.485   0.298   0.404  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.437  -0.550   1.325  1.00  0.00           C  
HETATM   25  O   UNL     1      -9.073   0.042  -0.057  1.00  0.00           O  
HETATM   26  O   UNL     1       5.588  -0.987   2.069  1.00  0.00           O  
HETATM   27  O   UNL     1       4.376  -2.520   1.036  1.00  0.00           O  
HETATM   28  O   UNL     1       7.806   2.782   0.241  1.00  0.00           O  
HETATM   29  O   UNL     1       6.844   1.957  -1.569  1.00  0.00           O  
HETATM   30  S   UNL     1       1.028   0.500   0.771  1.00  0.00           S  
HETATM   31  H   UNL     1      -7.603  -1.559   1.402  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.155  -1.452   1.605  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.361  -1.368   1.756  1.00  0.00           H  
HETATM   34  H   UNL     1       4.408  -2.118  -1.566  1.00  0.00           H  
HETATM   35  H   UNL     1       3.408   0.380   1.044  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.293   1.978  -0.922  1.00  0.00           H  
HETATM   37  H   UNL     1       2.780  -3.207  -3.057  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.537   1.785  -1.261  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.088   1.900  -1.064  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.845   2.083  -0.724  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.484   2.010  -0.530  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.314   0.908  -1.917  1.00  0.00           H  
HETATM   43  H   UNL     1     -10.777   0.845  -0.905  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.390  -1.047  -1.194  1.00  0.00           H  
HETATM   45  H   UNL     1       0.384  -2.678  -2.866  1.00  0.00           H  
HETATM   46  H   UNL     1       5.524  -0.217  -1.071  1.00  0.00           H  
HETATM   47  H   UNL     1       4.415   1.175  -1.116  1.00  0.00           H  
HETATM   48  H   UNL     1       5.298   1.949   1.069  1.00  0.00           H  
HETATM   49  H   UNL     1       6.406   0.557   1.114  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.913  -1.253   1.956  1.00  0.00           H  
HETATM   51  H   UNL     1       6.021  -1.695   2.565  1.00  0.00           H  
HETATM   52  H   UNL     1       8.425   3.257  -0.330  1.00  0.00           H  
CONECT    1   13   25    2    2                                       
CONECT    2    1    1    3   31                                       
CONECT    3    9    9    2   32                                       
CONECT    4   23   23   24   33                                       
CONECT    5   15   30   24   24                                       
CONECT    6    7    7   11   34                                       
CONECT    7    8    6    6   17                                       
CONECT    8   20   12    7   35                                       
CONECT    9   14   23    3    3                                       
CONECT   10   15   15   23   36                                       
CONECT   11    6   19   19   37                                       
CONECT   12   27   27   26    8                                       
CONECT   13   14   14    1   38                                       
CONECT   14   13   13    9   39                                       
CONECT   15   10   10    5   40                                       
CONECT   16   25   41   42   43                                       
CONECT   17    7   30   18   18                                       
CONECT   18   17   17   19   44                                       
CONECT   19   11   11   18   45                                       
CONECT   20   21    8   46   47                                       
CONECT   21   22   20   48   49                                       
CONECT   22   29   29   28   21                                       
CONECT   23   10    9    4    4                                       
CONECT   24    5    5    4   50                                       
CONECT   25    1   16                                                 
CONECT   26   12   51                                                 
CONECT   27   12   12                                                 
CONECT   28   22   52                                                 
CONECT   29   22   22                                                 
CONECT   30    5   17                                                 
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   24                                                      
CONECT   51   26                                                      
CONECT   52   28                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
