COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.998  -0.382   0.006  1.00  0.00           C  
HETATM    2  N   UNL     1       3.254   0.106   0.009  1.00  0.00           N  
HETATM    3  C   UNL     1       4.397  -0.811   0.013  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.225  -1.508  -0.003  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.549   0.919  -0.002  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.482   0.019   0.000  1.00  0.00           C  
HETATM    7  C   UNL     1       0.851   0.539   0.003  1.00  0.00           C  
HETATM    8  C   UNL     1       1.064   1.910   0.003  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.007   2.784   0.001  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.302   2.301  -0.002  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.027   4.564  -0.004  1.00  0.00           C  
HETATM   12  C   UNL     1       5.698  -0.005   0.016  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.901  -1.318   0.000  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.884  -2.828   0.002  1.00  0.00           C  
HETATM   15  N   UNL     1       6.843  -0.925   0.019  1.00  0.00           N  
HETATM   16  N   UNL     1      -4.260  -2.911   0.004  1.00  0.00           N  
HETATM   17  N   UNL     1      -2.164  -3.916   0.004  1.00  0.00           N  
HETATM   18  O   UNL     1      -2.344   3.171  -0.004  1.00  0.00           O  
HETATM   19  O   UNL     1       1.813  -1.584   0.001  1.00  0.00           O  
HETATM   20  S   UNL     1      -3.069   0.030  -0.005  1.00  0.00           S  
HETATM   21  H   UNL     1       3.402   1.065   0.010  1.00  0.00           H  
HETATM   22  H   UNL     1       4.356  -1.439   0.902  1.00  0.00           H  
HETATM   23  H   UNL     1       4.361  -1.439  -0.877  1.00  0.00           H  
HETATM   24  H   UNL     1       2.072   2.296   0.006  1.00  0.00           H  
HETATM   25  H   UNL     1       0.170   3.849   0.002  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.948   5.147  -0.006  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.447   4.804   0.887  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.443   4.804  -0.892  1.00  0.00           H  
HETATM   29  H   UNL     1       5.738   0.623  -0.874  1.00  0.00           H  
HETATM   30  H   UNL     1       5.734   0.623   0.906  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.201  -2.141   0.002  1.00  0.00           H  
HETATM   32  H   UNL     1       6.798  -1.561  -0.762  1.00  0.00           H  
HETATM   33  H   UNL     1       7.715  -0.416   0.021  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.795  -2.102   0.003  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.694  -3.779   0.007  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.196  -3.858   0.002  1.00  0.00           H  
CONECT    1    2   19   19    7                                       
CONECT    2    3    1   21                                            
CONECT    3    2   12   22   23                                       
CONECT    4   13   13   14   20                                       
CONECT    5    6    6   10   20                                       
CONECT    6    7   13    5    5                                       
CONECT    7    1    8    8    6                                       
CONECT    8    7    7    9   24                                       
CONECT    9    8   10   10   25                                       
CONECT   10    9    9    5   18                                       
CONECT   11   18   26   27   28                                       
CONECT   12    3   15   29   30                                       
CONECT   13    6    4    4   31                                       
CONECT   14   16    4   17   17                                       
CONECT   15   12   32   33                                            
CONECT   16   14   34   35                                            
CONECT   17   14   14   36                                            
CONECT   18   10   11                                                 
CONECT   19    1    1                                                 
CONECT   20    4    5                                                 
CONECT   21    2                                                      
CONECT   22    3                                                      
CONECT   23    3                                                      
CONECT   24    8                                                      
CONECT   25    9                                                      
CONECT   26   11                                                      
CONECT   27   11                                                      
CONECT   28   11                                                      
CONECT   29   12                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   15                                                      
CONECT   33   15                                                      
CONECT   34   16                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
