COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.199  -0.912   0.150  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.944  -1.651  -0.648  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.768   0.381   0.495  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.015   0.577  -0.105  1.00  0.00           C  
HETATM    5  C   UNL     1       1.408  -1.864  -0.270  1.00  0.00           C  
HETATM    6  C   UNL     1       0.287  -0.857  -0.215  1.00  0.00           C  
HETATM    7  S   UNL     1      -4.438  -0.834  -1.067  1.00  0.00           S  
HETATM    8  C   UNL     1       1.057  -3.165   0.067  1.00  0.00           C  
HETATM    9  C   UNL     1       2.736  -1.620  -0.624  1.00  0.00           C  
HETATM   10  C   UNL     1       0.809   0.438   0.355  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.863  -1.375   0.671  1.00  0.00           C  
HETATM   12  S   UNL     1      -0.670  -3.187   0.474  1.00  0.00           S  
HETATM   13  C   UNL     1       1.994  -4.189   0.050  1.00  0.00           C  
HETATM   14  C   UNL     1       3.666  -2.635  -0.638  1.00  0.00           C  
HETATM   15  C   UNL     1       1.333   1.480  -0.544  1.00  0.00           C  
HETATM   16  O   UNL     1       0.797   0.621   1.553  1.00  0.00           O  
HETATM   17  C   UNL     1       3.303  -3.926  -0.301  1.00  0.00           C  
HETATM   18  C   UNL     1       2.497   2.196  -0.198  1.00  0.00           C  
HETATM   19  C   UNL     1       0.685   1.760  -1.747  1.00  0.00           C  
HETATM   20  C   UNL     1       2.981   3.178  -1.058  1.00  0.00           C  
HETATM   21  C   UNL     1       3.198   1.907   1.071  1.00  0.00           C  
HETATM   22  C   UNL     1       1.182   2.738  -2.587  1.00  0.00           C  
HETATM   23  C   UNL     1       2.321   3.445  -2.243  1.00  0.00           C  
HETATM   24  O   UNL     1       3.223   0.774   1.507  1.00  0.00           O  
HETATM   25  O   UNL     1       3.810   2.901   1.744  1.00  0.00           O  
HETATM   26  C   UNL     1      -4.712   1.769   0.116  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.173   2.746   0.919  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.934   2.554   1.517  1.00  0.00           C  
HETATM   29  C   UNL     1      -2.240   1.401   1.315  1.00  0.00           C  
HETATM   30  H   UNL     1      -2.670  -2.635  -0.999  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.088  -0.680  -1.223  1.00  0.00           H  
HETATM   32  H   UNL     1       3.039  -0.618  -0.892  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.724  -1.075   1.709  1.00  0.00           H  
HETATM   34  H   UNL     1       1.698  -5.194   0.312  1.00  0.00           H  
HETATM   35  H   UNL     1       4.688  -2.422  -0.916  1.00  0.00           H  
HETATM   36  H   UNL     1       4.034  -4.721  -0.315  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.204   1.213  -2.022  1.00  0.00           H  
HETATM   38  H   UNL     1       3.872   3.730  -0.799  1.00  0.00           H  
HETATM   39  H   UNL     1       0.678   2.953  -3.518  1.00  0.00           H  
HETATM   40  H   UNL     1       2.700   4.208  -2.907  1.00  0.00           H  
HETATM   41  H   UNL     1       4.255   2.663   2.569  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.675   1.923  -0.347  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.715   3.665   1.087  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.519   3.326   2.147  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.277   1.266   1.786  1.00  0.00           H  
CONECT    1    2    2    3   11                                       
CONECT    2    1    1    7   30                                       
CONECT    3    1    4    4   29                                       
CONECT    4    3    3    7   26                                       
CONECT    5    6    8    8    9                                       
CONECT    6    5   10   11   31                                       
CONECT    7    2    4                                                 
CONECT    8    5    5   12   13                                       
CONECT    9    5   14   14   32                                       
CONECT   10    6   15   16   16                                       
CONECT   11    1    6   12   33                                       
CONECT   12    8   11                                                 
CONECT   13    8   17   17   34                                       
CONECT   14    9    9   17   35                                       
CONECT   15   10   18   18   19                                       
CONECT   16   10   10                                                 
CONECT   17   13   13   14   36                                       
CONECT   18   15   15   20   21                                       
CONECT   19   15   22   22   37                                       
CONECT   20   18   23   23   38                                       
CONECT   21   18   24   24   25                                       
CONECT   22   19   19   23   39                                       
CONECT   23   20   20   22   40                                       
CONECT   24   21   21                                                 
CONECT   25   21   41                                                 
CONECT   26    4   27   27   42                                       
CONECT   27   26   26   28   43                                       
CONECT   28   27   29   29   44                                       
CONECT   29    3   28   28   45                                       
CONECT   30    2                                                      
CONECT   31    6                                                      
CONECT   32    9                                                      
CONECT   33   11                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   17                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   22                                                      
CONECT   40   23                                                      
CONECT   41   25                                                      
CONECT   42   26                                                      
CONECT   43   27                                                      
CONECT   44   28                                                      
CONECT   45   29                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
