COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.856   0.954   0.016  1.00  0.00           C  
HETATM    2  C   UNL     1       2.479   2.685   0.062  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.170   2.089   0.041  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.855  -0.331  -0.020  1.00  0.00           C  
HETATM    5  N   UNL     1       3.315  -1.739   0.473  1.00  0.00           N  
HETATM    6  C   UNL     1       2.564   4.189   0.088  1.00  0.00           C  
HETATM    7  C   UNL     1       4.024  -2.852   0.474  1.00  0.00           C  
HETATM    8  C   UNL     1       5.870  -1.696  -0.512  1.00  0.00           C  
HETATM    9  C   UNL     1       5.316  -2.868  -0.014  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.338  -1.735  -0.066  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.095  -0.576  -0.048  1.00  0.00           C  
HETATM   12  C   UNL     1       1.647   0.593   0.024  1.00  0.00           C  
HETATM   13  N   UNL     1       3.021   0.551   0.025  1.00  0.00           N  
HETATM   14  C   UNL     1       1.276   1.920   0.046  1.00  0.00           C  
HETATM   15  N   UNL     1       3.492   1.867   0.049  1.00  0.00           N  
HETATM   16  S   UNL     1       0.219  -0.432   0.003  1.00  0.00           S  
HETATM   17  N   UNL     1      -2.250   0.873   0.006  1.00  0.00           N  
HETATM   18  C   UNL     1       3.808  -0.602   0.007  1.00  0.00           C  
HETATM   19  O   UNL     1      -2.187  -1.347  -0.035  1.00  0.00           O  
HETATM   20  C   UNL     1      -4.331  -0.416  -0.030  1.00  0.00           C  
HETATM   21  C   UNL     1       5.101  -0.546  -0.500  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.961  -1.662  -0.057  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.101   0.748  -0.023  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.477   0.661  -0.027  1.00  0.00           C  
HETATM   25  H   UNL     1      -0.645   3.059   0.056  1.00  0.00           H  
HETATM   26  H   UNL     1       2.582   4.534   1.121  1.00  0.00           H  
HETATM   27  H   UNL     1       3.474   4.510  -0.419  1.00  0.00           H  
HETATM   28  H   UNL     1       1.697   4.611  -0.421  1.00  0.00           H  
HETATM   29  H   UNL     1       3.589  -3.761   0.862  1.00  0.00           H  
HETATM   30  H   UNL     1       6.878  -1.683  -0.900  1.00  0.00           H  
HETATM   31  H   UNL     1       5.890  -3.783  -0.009  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.827  -2.697  -0.083  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.174  -0.639  -0.051  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.783   1.684   0.019  1.00  0.00           H  
HETATM   35  H   UNL     1       5.500   0.383  -0.878  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.371  -2.566  -0.070  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.620   1.715  -0.011  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.074   1.561  -0.022  1.00  0.00           H  
CONECT    1   16   17    3    3                                       
CONECT    2   14   15   15    6                                       
CONECT    3   14    1    1   25                                       
CONECT    4   17   19   19   20                                       
CONECT    5   18   18    7                                            
CONECT    6    2   26   27   28                                       
CONECT    7    5    9    9   29                                       
CONECT    8   21   21    9   30                                       
CONECT    9    7    7    8   31                                       
CONECT   10   22   11   11   32                                       
CONECT   11   10   10   24   33                                       
CONECT   12   14   14   13   16                                       
CONECT   13   12   15   18                                            
CONECT   14   12   12    2    3                                       
CONECT   15   13    2    2                                            
CONECT   16   12    1                                                 
CONECT   17    1    4   34                                            
CONECT   18   13    5    5   21                                       
CONECT   19    4    4                                                 
CONECT   20    4   22   22   23                                       
CONECT   21   18    8    8   35                                       
CONECT   22   20   20   10   36                                       
CONECT   23   20   24   24   37                                       
CONECT   24   23   23   11   38                                       
CONECT   25    3                                                      
CONECT   26    6                                                      
CONECT   27    6                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   17                                                      
CONECT   35   21                                                      
CONECT   36   22                                                      
CONECT   37   23                                                      
CONECT   38   24                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
