COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.395  -0.258  -0.096  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.780   1.171  -1.272  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.876   0.803  -0.501  1.00  0.00           C  
HETATM    4  N   UNL     1       3.101   3.479  -0.960  1.00  0.00           N  
HETATM    5  C   UNL     1       3.524   2.280  -0.435  1.00  0.00           C  
HETATM    6  N   UNL     1       3.515   1.254  -1.200  1.00  0.00           N  
HETATM    7  C   UNL     1       3.880  -0.110  -0.883  1.00  0.00           C  
HETATM    8  C   UNL     1       2.622  -0.910  -0.658  1.00  0.00           C  
HETATM    9  C   UNL     1       1.388  -0.301  -0.771  1.00  0.00           C  
HETATM   10  C   UNL     1       0.229  -1.039  -0.564  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.022  -0.424  -0.678  1.00  0.00           N  
HETATM   12  C   UNL     1      -2.044  -0.825   0.104  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.855  -1.653   0.975  1.00  0.00           O  
HETATM   14  N   UNL     1      -3.596   0.642  -1.053  1.00  0.00           N  
HETATM   15  O   UNL     1      -7.092   1.361  -0.736  1.00  0.00           O  
HETATM   16  C   UNL     1      -8.226   0.683  -0.184  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.910   0.319   1.273  1.00  0.00           C  
HETATM   18  O   UNL     1      -6.754  -0.528   1.285  1.00  0.00           O  
HETATM   19  C   UNL     1      -5.709  -0.140   0.512  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.447  -0.678   0.718  1.00  0.00           C  
HETATM   21  C   UNL     1       0.315  -2.387  -0.243  1.00  0.00           C  
HETATM   22  C   UNL     1       1.552  -2.992  -0.132  1.00  0.00           C  
HETATM   23  C   UNL     1       2.706  -2.256  -0.344  1.00  0.00           C  
HETATM   24  F   UNL     1       3.914  -2.850  -0.235  1.00  0.00           F  
HETATM   25  C   UNL     1       4.639  -0.707  -2.070  1.00  0.00           C  
HETATM   26  C   UNL     1       4.756  -0.211   0.360  1.00  0.00           C  
HETATM   27  F   UNL     1       5.977   0.433   0.129  1.00  0.00           F  
HETATM   28  C   UNL     1       4.035   0.462   1.536  1.00  0.00           C  
HETATM   29  S   UNL     1       4.052   2.252   1.242  1.00  0.00           S  
HETATM   30  C   UNL     1       4.766   0.146   2.842  1.00  0.00           C  
HETATM   31  H   UNL     1      -4.901   1.900  -2.059  1.00  0.00           H  
HETATM   32  H   UNL     1       2.808   3.529  -1.883  1.00  0.00           H  
HETATM   33  H   UNL     1       3.096   4.276  -0.406  1.00  0.00           H  
HETATM   34  H   UNL     1       1.323   0.748  -1.020  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.155   0.290  -1.321  1.00  0.00           H  
HETATM   36  H   UNL     1      -9.097   1.336  -0.218  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.425  -0.225  -0.754  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.706   1.226   1.842  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.757  -0.208   1.712  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.282  -1.410   1.495  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.584  -2.963  -0.082  1.00  0.00           H  
HETATM   42  H   UNL     1       1.620  -4.041   0.118  1.00  0.00           H  
HETATM   43  H   UNL     1       4.011  -0.667  -2.960  1.00  0.00           H  
HETATM   44  H   UNL     1       5.551  -0.136  -2.242  1.00  0.00           H  
HETATM   45  H   UNL     1       4.895  -1.744  -1.853  1.00  0.00           H  
HETATM   46  H   UNL     1       4.934  -1.261   0.594  1.00  0.00           H  
HETATM   47  H   UNL     1       3.007   0.103   1.592  1.00  0.00           H  
HETATM   48  H   UNL     1       5.789   0.519   2.785  1.00  0.00           H  
HETATM   49  H   UNL     1       4.250   0.626   3.673  1.00  0.00           H  
HETATM   50  H   UNL     1       4.781  -0.933   2.998  1.00  0.00           H  
CONECT    1   12   20   20   14                                       
CONECT    2   14   14    3   31                                       
CONECT    3    2   19   19   15                                       
CONECT    4    5   32   33                                            
CONECT    5   29    6    6    4                                       
CONECT    6    7    5    5                                            
CONECT    7   26   25    8    6                                       
CONECT    8   23    7    9    9                                       
CONECT    9    8    8   10   34                                       
CONECT   10   21   21    9   11                                       
CONECT   11   10   12   35                                            
CONECT   12   11   13   13    1                                       
CONECT   13   12   12                                                 
CONECT   14    1    2    2                                            
CONECT   15    3   16                                                 
CONECT   16   17   15   36   37                                       
CONECT   17   18   16   38   39                                       
CONECT   18   19   17                                                 
CONECT   19   20   18    3    3                                       
CONECT   20    1    1   19   40                                       
CONECT   21   22   10   10   41                                       
CONECT   22   23   23   21   42                                       
CONECT   23   24   22   22    8                                       
CONECT   24   23                                                      
CONECT   25    7   43   44   45                                       
CONECT   26   27   28    7   46                                       
CONECT   27   26                                                      
CONECT   28   30   26   29   47                                       
CONECT   29   28    5                                                 
CONECT   30   28   48   49   50                                       
CONECT   31    2                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   28                                                      
CONECT   48   30                                                      
CONECT   49   30                                                      
CONECT   50   30                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
