COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.745   1.868  -1.517  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.535   0.574  -1.953  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.793  -0.303  -1.185  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.258   0.111   0.021  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.632  -0.850   0.495  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.809   0.067   1.122  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.489   0.193   0.728  1.00  0.00           C  
HETATM    8  C   UNL     1       0.007  -0.598  -0.291  1.00  0.00           C  
HETATM    9  C   UNL     1       1.445  -0.460  -0.720  1.00  0.00           C  
HETATM   10  C   UNL     1       4.745  -0.220  -0.327  1.00  0.00           C  
HETATM   11  C   UNL     1       5.408   0.103   0.842  1.00  0.00           C  
HETATM   12  C   UNL     1       6.135   1.280   0.924  1.00  0.00           C  
HETATM   13  O   UNL     1       4.369  -2.593   0.547  1.00  0.00           O  
HETATM   14  C   UNL     1       6.196   2.134  -0.173  1.00  0.00           C  
HETATM   15  C   UNL     1       5.529   1.805  -1.342  1.00  0.00           C  
HETATM   16  C   UNL     1       4.809   0.627  -1.418  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.817  -1.515  -0.917  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.135  -1.645  -0.520  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.465   1.404   0.461  1.00  0.00           C  
HETATM   20  O   UNL     1       6.788   1.600   2.073  1.00  0.00           O  
HETATM   21  O   UNL     1      -4.380  -0.534   2.334  1.00  0.00           O  
HETATM   22  S   UNL     1      -4.313  -1.011   0.997  1.00  0.00           S  
HETATM   23  O   UNL     1      -4.722  -2.317   0.616  1.00  0.00           O  
HETATM   24  C   UNL     1      -6.205   2.288  -0.310  1.00  0.00           C  
HETATM   25  O   UNL     1      -6.410   3.561   0.121  1.00  0.00           O  
HETATM   26  N   UNL     1       2.278  -1.375   0.064  1.00  0.00           N  
HETATM   27  S   UNL     1       3.822  -1.717  -0.428  1.00  0.00           S  
HETATM   28  O   UNL     1       3.739  -2.045  -1.809  1.00  0.00           O  
HETATM   29  O   UNL     1       6.908   3.291  -0.097  1.00  0.00           O  
HETATM   30  H   UNL     1      -7.324   2.554  -2.118  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.951   0.248  -2.895  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.631  -1.315  -1.528  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.196   0.685   1.918  1.00  0.00           H  
HETATM   34  H   UNL     1       0.154   0.910   1.217  1.00  0.00           H  
HETATM   35  H   UNL     1       1.533  -0.705  -1.779  1.00  0.00           H  
HETATM   36  H   UNL     1       1.776   0.565  -0.556  1.00  0.00           H  
HETATM   37  H   UNL     1       5.360  -0.561   1.692  1.00  0.00           H  
HETATM   38  H   UNL     1       5.574   2.466  -2.194  1.00  0.00           H  
HETATM   39  H   UNL     1       4.290   0.370  -2.330  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.429  -2.134  -1.713  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.778  -2.362  -1.009  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.048   1.727   1.404  1.00  0.00           H  
HETATM   43  H   UNL     1       7.696   1.268   2.116  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.202   3.670   0.664  1.00  0.00           H  
HETATM   45  H   UNL     1       1.925  -1.781   0.872  1.00  0.00           H  
HETATM   46  H   UNL     1       7.832   3.201  -0.366  1.00  0.00           H  
CONECT    1   24   24    2   30                                       
CONECT    2    1    3    3   31                                       
CONECT    3    2    2    4   32                                       
CONECT    4    3   22   19   19                                       
CONECT    5   22    6    6   18                                       
CONECT    6    5    5    7   33                                       
CONECT    7    6    8    8   34                                       
CONECT    8    7    7    9   17                                       
CONECT    9    8   26   35   36                                       
CONECT   10   27   11   11   16                                       
CONECT   11   10   10   12   37                                       
CONECT   12   11   20   14   14                                       
CONECT   13   27   27                                                 
CONECT   14   12   12   29   15                                       
CONECT   15   14   16   16   38                                       
CONECT   16   15   15   10   39                                       
CONECT   17    8   18   18   40                                       
CONECT   18   17   17    5   41                                       
CONECT   19    4    4   24   42                                       
CONECT   20   12   43                                                 
CONECT   21   22   22                                                 
CONECT   22    4    5   23   23                                       
CONECT   22   21   21                                                 
CONECT   23   22   22                                                 
CONECT   24   25    1    1   19                                       
CONECT   25   24   44                                                 
CONECT   26    9   27   45                                            
CONECT   27   26   13   13   10                                       
CONECT   27   28   28                                                 
CONECT   28   27   27                                                 
CONECT   29   14   46                                                 
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   29                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
