COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.911   2.837   1.396  1.00  0.00           C  
HETATM    2  N   UNL     1      -2.011   0.526   0.663  1.00  0.00           N  
HETATM    3  O   UNL     1      -1.645   3.824   2.266  1.00  0.00           O  
HETATM    4  C   UNL     1      -1.632   1.405   1.772  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.599  -2.406   0.246  1.00  0.00           C  
HETATM    6  O   UNL     1       0.698   1.389   0.194  1.00  0.00           O  
HETATM    7  O   UNL     1       2.754   0.398  -3.292  1.00  0.00           O  
HETATM    8  O   UNL     1       2.442   2.243  -1.635  1.00  0.00           O  
HETATM    9  C   UNL     1       5.860  -2.698   1.874  1.00  0.00           C  
HETATM   10  C   UNL     1       5.651  -1.633   2.738  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.437  -0.938   0.932  1.00  0.00           C  
HETATM   12  C   UNL     1       5.329  -2.676   0.603  1.00  0.00           C  
HETATM   13  C   UNL     1       4.907  -0.542   2.342  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.360  -0.175   1.324  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.269  -1.639  -1.051  1.00  0.00           C  
HETATM   16  C   UNL     1       3.878  -1.221  -1.050  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.898  -0.627  -1.246  1.00  0.00           C  
HETATM   18  N   UNL     1       0.786   0.421  -1.804  1.00  0.00           N  
HETATM   19  O   UNL     1      -6.466  -2.419  -0.625  1.00  0.00           O  
HETATM   20  O   UNL     1       3.606   0.404   0.410  1.00  0.00           O  
HETATM   21  C   UNL     1       0.147   0.713  -0.654  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.393  -1.671  -0.253  1.00  0.00           C  
HETATM   23  C   UNL     1       3.324  -0.020  -0.835  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.217   0.214  -0.423  1.00  0.00           C  
HETATM   25  C   UNL     1       4.576  -1.578   0.191  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.165  -0.868  -0.663  1.00  0.00           C  
HETATM   27  C   UNL     1       4.359  -0.501   1.067  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.215  -0.130   0.535  1.00  0.00           C  
HETATM   29  S   UNL     1       2.365   0.875  -2.011  1.00  0.00           S  
HETATM   30  O   UNL     1      -2.378   3.097   0.312  1.00  0.00           O  
HETATM   31  H   UNL     1      -1.845   4.726   1.981  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.570   1.285   1.984  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.211   1.143   2.658  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.308  -2.780   1.227  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.973  -1.387   0.341  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.382  -3.042  -0.168  1.00  0.00           H  
HETATM   37  H   UNL     1       6.445  -3.546   2.198  1.00  0.00           H  
HETATM   38  H   UNL     1       6.074  -1.660   3.731  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.323  -0.971   1.549  1.00  0.00           H  
HETATM   40  H   UNL     1       5.497  -3.504  -0.070  1.00  0.00           H  
HETATM   41  H   UNL     1       4.750   0.281   3.024  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.405   0.389   2.244  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.242  -2.203  -1.972  1.00  0.00           H  
HETATM   44  H   UNL     1       3.821  -1.808  -1.955  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.534  -1.042  -2.174  1.00  0.00           H  
HETATM   46  H   UNL     1       0.321  -0.056  -2.509  1.00  0.00           H  
CONECT    1    4   30   30    3                                       
CONECT    2   28    4   24                                            
CONECT    3    1   31                                                 
CONECT    4    1    2   32   33                                       
CONECT    5   19   34   35   36                                       
CONECT    6   21   21                                                 
CONECT    7   29   29                                                 
CONECT    8   29   29                                                 
CONECT    9   10   10   12   37                                       
CONECT   10    9    9   13   38                                       
CONECT   11   22   22   14   39                                       
CONECT   12    9   25   25   40                                       
CONECT   13   10   27   27   41                                       
CONECT   14   11   28   28   42                                       
CONECT   15   22   26   26   43                                       
CONECT   16   23   23   25   44                                       
CONECT   17   26   24   24   45                                       
CONECT   18   21   29   46                                            
CONECT   19    5   22                                                 
CONECT   20   23   27                                                 
CONECT   21    6    6   18   24                                       
CONECT   22   11   11   15   19                                       
CONECT   23   16   16   20   29                                       
CONECT   24    2   17   17   21                                       
CONECT   25   12   12   16   27                                       
CONECT   26   15   15   17   28                                       
CONECT   27   13   13   20   25                                       
CONECT   28    2   14   14   26                                       
CONECT   29    7    7    8    8                                       
CONECT   29   18   23                                                 
CONECT   30    1    1                                                 
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
