COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -2.461  -0.668  -0.659  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.872  -0.393  -0.441  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.963  -0.560  -1.322  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.225  -0.241  -0.926  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.461   0.251   0.351  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.418   0.423   1.230  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.113   0.102   0.843  1.00  0.00           C  
HETATM    8  S   UNL     1      -2.598   0.212   1.730  1.00  0.00           S  
HETATM    9  C   UNL     1      -1.680  -0.405   0.370  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.187  -0.609   0.377  1.00  0.00           C  
HETATM   11  O   UNL     1       0.459   0.583  -0.074  1.00  0.00           O  
HETATM   12  C   UNL     1       1.815   0.567  -0.128  1.00  0.00           C  
HETATM   13  C   UNL     1       2.428  -0.525   0.231  1.00  0.00           C  
HETATM   14  C   UNL     1       3.920  -0.686   0.233  1.00  0.00           C  
HETATM   15  C   UNL     1       4.276  -2.039  -0.328  1.00  0.00           C  
HETATM   16  O   UNL     1       4.554  -2.153  -1.498  1.00  0.00           O  
HETATM   17  O   UNL     1       4.286  -3.116   0.472  1.00  0.00           O  
HETATM   18  O   UNL     1       4.405  -0.586   1.573  1.00  0.00           O  
HETATM   19  C   UNL     1       4.569   0.405  -0.621  1.00  0.00           C  
HETATM   20  C   UNL     1       3.992   1.761  -0.198  1.00  0.00           C  
HETATM   21  O   UNL     1       4.702   2.812  -0.857  1.00  0.00           O  
HETATM   22  C   UNL     1       2.516   1.805  -0.604  1.00  0.00           C  
HETATM   23  O   UNL     1       1.900   2.953  -0.017  1.00  0.00           O  
HETATM   24  C   UNL     1      -7.376  -0.424  -1.880  1.00  0.00           C  
HETATM   25  H   UNL     1      -2.082  -1.060  -1.591  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.794  -0.942  -2.318  1.00  0.00           H  
HETATM   27  H   UNL     1      -7.468   0.501   0.654  1.00  0.00           H  
HETATM   28  H   UNL     1      -7.787  -1.428  -1.766  1.00  0.00           H  
HETATM   29  H   UNL     1      -8.149   0.312  -1.663  1.00  0.00           H  
HETATM   30  H   UNL     1      -7.024  -0.291  -2.904  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.608   0.806   2.222  1.00  0.00           H  
HETATM   32  H   UNL     1       0.144  -0.842   1.389  1.00  0.00           H  
HETATM   33  H   UNL     1       0.070  -1.435  -0.288  1.00  0.00           H  
HETATM   34  H   UNL     1       1.826  -1.364   0.546  1.00  0.00           H  
HETATM   35  H   UNL     1       2.438   1.870  -1.689  1.00  0.00           H  
HETATM   36  H   UNL     1       4.044  -1.253   2.173  1.00  0.00           H  
HETATM   37  H   UNL     1       5.648   0.400  -0.464  1.00  0.00           H  
HETATM   38  H   UNL     1       4.349   0.226  -1.674  1.00  0.00           H  
HETATM   39  H   UNL     1       4.521  -3.962   0.067  1.00  0.00           H  
HETATM   40  H   UNL     1       4.086   1.878   0.882  1.00  0.00           H  
HETATM   41  H   UNL     1       4.388   3.699  -0.634  1.00  0.00           H  
HETATM   42  H   UNL     1       0.963   3.052  -0.237  1.00  0.00           H  
CONECT    1    2    9    9   25                                       
CONECT    2    1    3    7    7                                       
CONECT    3    2    4    4   26                                       
CONECT    4    3    3    5   24                                       
CONECT    5    4    6    6   27                                       
CONECT    6    5    5    7   31                                       
CONECT    7    2    2    6    8                                       
CONECT    8    7    9                                                 
CONECT    9    1    1    8   10                                       
CONECT   10    9   11   32   33                                       
CONECT   11   10   12                                                 
CONECT   12   11   13   13   22                                       
CONECT   13   12   12   14   34                                       
CONECT   14   13   15   18   19                                       
CONECT   15   14   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   39                                                 
CONECT   18   14   36                                                 
CONECT   19   14   20   37   38                                       
CONECT   20   19   21   22   40                                       
CONECT   21   20   41                                                 
CONECT   22   12   20   23   35                                       
CONECT   23   22   42                                                 
CONECT   24    4   28   29   30                                       
CONECT   25    1                                                      
CONECT   26    3                                                      
CONECT   27    5                                                      
CONECT   28   24                                                      
CONECT   29   24                                                      
CONECT   30   24                                                      
CONECT   31    6                                                      
CONECT   32   10                                                      
CONECT   33   10                                                      
CONECT   34   13                                                      
CONECT   35   22                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   19                                                      
CONECT   39   17                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   23                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
