COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       6.953  -1.330   0.805  1.00  0.00           O  
HETATM    2  C   UNL     1       7.154  -0.175  -1.573  1.00  0.00           C  
HETATM    3  S   UNL     1       6.712  -0.075   0.183  1.00  0.00           S  
HETATM    4  C   UNL     1       2.824  -1.081   0.151  1.00  0.00           C  
HETATM    5  C   UNL     1       4.202  -1.146   0.182  1.00  0.00           C  
HETATM    6  C   UNL     1       4.953   0.016   0.145  1.00  0.00           C  
HETATM    7  C   UNL     1       4.328   1.249   0.078  1.00  0.00           C  
HETATM    8  C   UNL     1       2.951   1.327   0.047  1.00  0.00           C  
HETATM    9  C   UNL     1       2.188   0.159   0.083  1.00  0.00           C  
HETATM   10  N   UNL     1      -4.668   3.609  -0.196  1.00  0.00           N  
HETATM   11  C   UNL     1      -3.680   3.893   0.632  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.574   3.075   0.722  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.510   1.928  -0.081  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.582   1.666  -0.945  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.649   2.539  -0.970  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.019   1.386  -0.014  1.00  0.00           N  
HETATM   17  C   UNL     1       0.712   0.236   0.051  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.105  -0.793   0.080  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.374  -0.361   0.035  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.347   1.023  -0.020  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.738  -0.778   0.708  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.865  -1.573   0.717  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.854  -2.803   0.078  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.712  -3.240  -0.574  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.580  -2.451  -0.589  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.588  -1.211   0.049  1.00  0.00           C  
HETATM   27  F   UNL     1      -5.961  -3.578   0.090  1.00  0.00           F  
HETATM   28  H   UNL     1       6.698  -1.062  -2.013  1.00  0.00           H  
HETATM   29  H   UNL     1       6.792   0.713  -2.090  1.00  0.00           H  
HETATM   30  H   UNL     1       8.238  -0.237  -1.672  1.00  0.00           H  
HETATM   31  H   UNL     1       2.239  -1.989   0.176  1.00  0.00           H  
HETATM   32  H   UNL     1       4.695  -2.105   0.234  1.00  0.00           H  
HETATM   33  H   UNL     1       4.920   2.152   0.050  1.00  0.00           H  
HETATM   34  H   UNL     1       2.465   2.290  -0.006  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.738   4.779   1.246  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.769   3.315   1.401  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.573   0.794  -1.581  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.480   2.346  -1.631  1.00  0.00           H  
HETATM   39  H   UNL     1       0.331   2.290  -0.047  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.747   0.179   1.207  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.758  -1.237   1.224  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.708  -4.199  -1.070  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.690  -2.793  -1.096  1.00  0.00           H  
CONECT    1    3    3                                                 
CONECT    2    3   28   29   30                                       
CONECT    3    1    1    6    2                                       
CONECT    4    5    5    9   31                                       
CONECT    5    4    4    6   32                                       
CONECT    6    5    3    7    7                                       
CONECT    7    6    6    8   33                                       
CONECT    8    9    9    7   34                                       
CONECT    9    4   17    8    8                                       
CONECT   10   11   15   15                                            
CONECT   11   12   12   10   35                                       
CONECT   12   11   11   13   36                                       
CONECT   13   12   20   14   14                                       
CONECT   14   13   13   15   37                                       
CONECT   15   10   10   14   38                                       
CONECT   16   20   17   39                                            
CONECT   17   18   18    9   16                                       
CONECT   18   19   17   17                                            
CONECT   19   26   18   20   20                                       
CONECT   20   19   19   13   16                                       
CONECT   21   22   22   26   40                                       
CONECT   22   23   21   21   41                                       
CONECT   23   27   24   24   22                                       
CONECT   24   23   23   25   42                                       
CONECT   25   24   26   26   43                                       
CONECT   26   25   25   21   19                                       
CONECT   27   23                                                      
CONECT   28    2                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   24                                                      
CONECT   43   25                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
