COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.515   0.737  -0.280  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.904  -0.605  -0.433  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.282  -1.078  -1.715  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.260  -0.195  -2.809  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.877   1.098  -2.623  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.511   1.564  -1.361  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.927  -1.487   0.660  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.310  -2.780   0.474  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.681  -3.245  -0.786  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.672  -2.419  -1.868  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.520   0.668   1.039  1.00  0.00           C  
HETATM   12  C   UNL     1       0.852   0.604  -0.029  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.157   1.526  -0.575  1.00  0.00           C  
HETATM   14  C   UNL     1       2.132   0.421  -0.440  1.00  0.00           C  
HETATM   15  C   UNL     1       2.937  -0.667   0.128  1.00  0.00           C  
HETATM   16  C   UNL     1       2.312  -1.790   0.683  1.00  0.00           C  
HETATM   17  C   UNL     1       3.075  -2.807   1.215  1.00  0.00           C  
HETATM   18  C   UNL     1       4.458  -2.724   1.203  1.00  0.00           C  
HETATM   19  C   UNL     1       5.089  -1.621   0.659  1.00  0.00           C  
HETATM   20  C   UNL     1       4.340  -0.590   0.114  1.00  0.00           C  
HETATM   21  C   UNL     1       6.314   0.474  -0.508  1.00  0.00           C  
HETATM   22  C   UNL     1       6.937  -0.274  -1.497  1.00  0.00           C  
HETATM   23  C   UNL     1       8.315  -0.291  -1.584  1.00  0.00           C  
HETATM   24  C   UNL     1       9.075   0.437  -0.687  1.00  0.00           C  
HETATM   25  C   UNL     1       8.457   1.184   0.299  1.00  0.00           C  
HETATM   26  C   UNL     1       7.079   1.209   0.387  1.00  0.00           C  
HETATM   27  N   UNL     1      -2.678   0.525   1.758  1.00  0.00           N  
HETATM   28  N   UNL     1      -1.323   1.487   0.032  1.00  0.00           N  
HETATM   29  O   UNL     1      -3.650   2.699   1.112  1.00  0.00           O  
HETATM   30  O   UNL     1      -5.066   0.955   2.207  1.00  0.00           O  
HETATM   31  O   UNL     1       0.070   2.270  -1.516  1.00  0.00           O  
HETATM   32  O   UNL     1       4.958   0.493  -0.421  1.00  0.00           O  
HETATM   33  S   UNL     1      -4.042   1.347   1.304  1.00  0.00           S  
HETATM   34  S   UNL     1      -0.003  -0.210   1.298  1.00  0.00           S  
HETATM   35  H   UNL     1      -5.541  -0.542  -3.792  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.861   1.774  -3.465  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.211   2.594  -1.241  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.641  -1.142   1.643  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.327  -3.457   1.316  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.980  -4.275  -0.906  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.962  -2.793  -2.839  1.00  0.00           H  
HETATM   42  H   UNL     1       2.558   1.075  -1.186  1.00  0.00           H  
HETATM   43  H   UNL     1       1.235  -1.859   0.695  1.00  0.00           H  
HETATM   44  H   UNL     1       2.593  -3.673   1.643  1.00  0.00           H  
HETATM   45  H   UNL     1       5.047  -3.526   1.622  1.00  0.00           H  
HETATM   46  H   UNL     1       6.168  -1.567   0.651  1.00  0.00           H  
HETATM   47  H   UNL     1       6.344  -0.843  -2.198  1.00  0.00           H  
HETATM   48  H   UNL     1       8.800  -0.873  -2.354  1.00  0.00           H  
HETATM   49  H   UNL     1      10.153   0.423  -0.756  1.00  0.00           H  
HETATM   50  H   UNL     1       9.052   1.751   0.999  1.00  0.00           H  
HETATM   51  H   UNL     1       6.596   1.795   1.155  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.698  -0.058   2.533  1.00  0.00           H  
CONECT    1    6    6    2   33                                       
CONECT    2    3    1    7    7                                       
CONECT    3    4   10   10    2                                       
CONECT    4    5    5    3   35                                       
CONECT    5    4    4    6   36                                       
CONECT    6    5    1    1   37                                       
CONECT    7    2    2    8   38                                       
CONECT    8    9    9    7   39                                       
CONECT    9   10    8    8   40                                       
CONECT   10    3    3    9   41                                       
CONECT   11   34   27   28   28                                       
CONECT   12   34   14   14   13                                       
CONECT   13   12   28   31   31                                       
CONECT   14   15   12   12   42                                       
CONECT   15   20   14   16   16                                       
CONECT   16   15   15   17   43                                       
CONECT   17   18   18   16   44                                       
CONECT   18   19   17   17   45                                       
CONECT   19   20   20   18   46                                       
CONECT   20   32   19   19   15                                       
CONECT   21   22   32   26   26                                       
CONECT   22   23   23   21   47                                       
CONECT   23   22   22   24   48                                       
CONECT   24   23   25   25   49                                       
CONECT   25   24   24   26   50                                       
CONECT   26   21   21   25   51                                       
CONECT   27   33   11   52                                            
CONECT   28   11   11   13                                            
CONECT   29   33   33                                                 
CONECT   30   33   33                                                 
CONECT   31   13   13                                                 
CONECT   32   21   20                                                 
CONECT   33    1   29   29   30                                       
CONECT   33   30   27                                                 
CONECT   34   12   11                                                 
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   14                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
