COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.231   0.765  -0.512  1.00  0.00           C  
HETATM    2  C   UNL     1       4.112  -0.322  -0.390  1.00  0.00           C  
HETATM    3  C   UNL     1       5.301  -0.383  -1.138  1.00  0.00           C  
HETATM    4  C   UNL     1       6.132  -1.451  -0.993  1.00  0.00           C  
HETATM    5  C   UNL     1       5.820  -2.486  -0.114  1.00  0.00           C  
HETATM    6  C   UNL     1       4.677  -2.459   0.625  1.00  0.00           C  
HETATM    7  C   UNL     1       3.792  -1.373   0.506  1.00  0.00           C  
HETATM    8  N   UNL     1       2.664  -1.327   1.223  1.00  0.00           N  
HETATM    9  C   UNL     1       1.828  -0.326   1.127  1.00  0.00           C  
HETATM   10  C   UNL     1       2.073   0.756   0.261  1.00  0.00           C  
HETATM   11  C   UNL     1       1.115   1.874   0.177  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.276   1.766   0.084  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.180   0.693   0.039  1.00  0.00           C  
HETATM   14  N   UNL     1       1.420   3.190   0.183  1.00  0.00           N  
HETATM   15  N   UNL     1       0.249   3.949   0.089  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.794   3.140   0.027  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.190   3.339  -0.072  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.023   2.272  -0.113  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.535   0.952  -0.058  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.487  -0.176  -0.105  1.00  0.00           C  
HETATM   21  S   UNL     1      -3.072  -1.887  -0.042  1.00  0.00           S  
HETATM   22  C   UNL     1      -4.830  -0.077  -0.198  1.00  0.00           C  
HETATM   23  N   UNL     1      -5.457  -1.235  -0.223  1.00  0.00           N  
HETATM   24  C   UNL     1      -4.726  -2.305  -0.154  1.00  0.00           C  
HETATM   25  N   UNL     1      -5.215  -3.600  -0.165  1.00  0.00           N  
HETATM   26  H   UNL     1       3.447   1.584  -1.182  1.00  0.00           H  
HETATM   27  H   UNL     1       5.553   0.413  -1.823  1.00  0.00           H  
HETATM   28  H   UNL     1       7.045  -1.498  -1.568  1.00  0.00           H  
HETATM   29  H   UNL     1       6.495  -3.323  -0.017  1.00  0.00           H  
HETATM   30  H   UNL     1       4.451  -3.270   1.302  1.00  0.00           H  
HETATM   31  H   UNL     1       0.929  -0.329   1.725  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.821  -0.325   0.079  1.00  0.00           H  
HETATM   33  H   UNL     1       2.317   3.554   0.244  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.592   4.340  -0.115  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.087   2.438  -0.188  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.345   0.870  -0.248  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.603  -4.350  -0.106  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.170  -3.757  -0.231  1.00  0.00           H  
CONECT    1    2    2   10   26                                       
CONECT    2    7    3    1    1                                       
CONECT    3    4    4    2   27                                       
CONECT    4    5    3    3   28                                       
CONECT    5    6    6    4   29                                       
CONECT    6    5    5    7   30                                       
CONECT    7    6    8    8    2                                       
CONECT    8    7    7    9                                            
CONECT    9    8   10   10   31                                       
CONECT   10    9    9    1   11                                       
CONECT   11   10   12   12   14                                       
CONECT   12   11   11   13   16                                       
CONECT   13   12   19   19   32                                       
CONECT   14   11   15   33                                            
CONECT   15   14   16   16                                            
CONECT   16   12   15   15   17                                       
CONECT   17   16   18   18   34                                       
CONECT   18   19   17   17   35                                       
CONECT   19   13   13   20   18                                       
CONECT   20   21   19   22   22                                       
CONECT   21   24   20                                                 
CONECT   22   23   20   20   36                                       
CONECT   23   24   24   22                                            
CONECT   24   25   21   23   23                                       
CONECT   25   24   37   38                                            
CONECT   26    1                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    9                                                      
CONECT   32   13                                                      
CONECT   33   14                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   22                                                      
CONECT   37   25                                                      
CONECT   38   25                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
