COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.601  -2.217   1.283  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.851  -1.707  -0.137  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.628  -0.417  -0.078  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.118   0.839  -0.009  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.335   1.090  -0.019  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.696   1.738   0.001  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.088  -0.268  -0.089  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.082  -1.342  -0.162  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.515  -1.879  -1.501  1.00  0.00           C  
HETATM   10  C   UNL     1       0.320   1.183   0.022  1.00  0.00           C  
HETATM   11  C   UNL     1       0.799   2.378  -0.386  1.00  0.00           C  
HETATM   12  C   UNL     1       2.472   0.766   0.435  1.00  0.00           C  
HETATM   13  C   UNL     1       3.664  -0.039   0.887  1.00  0.00           C  
HETATM   14  C   UNL     1       4.220  -0.833  -0.296  1.00  0.00           C  
HETATM   15  C   UNL     1       5.944  -2.395  -0.968  1.00  0.00           C  
HETATM   16  N   UNL     1      -2.155   1.736   0.028  1.00  0.00           N  
HETATM   17  N   UNL     1       5.382  -1.617   0.144  1.00  0.00           N  
HETATM   18  N   UNL     1       1.253   0.348   0.458  1.00  0.00           N  
HETATM   19  O   UNL     1      -4.556  -1.799   0.857  1.00  0.00           O  
HETATM   20  S   UNL     1       2.548   2.359  -0.178  1.00  0.00           S  
HETATM   21  H   UNL     1      -0.039  -3.150   1.240  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.031  -1.475   1.842  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.556  -2.391   1.780  1.00  0.00           H  
HETATM   24  H   UNL     1       0.104  -1.533  -0.634  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.421  -2.449  -0.695  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.980   2.017  -1.013  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.426   1.036   0.403  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.665   2.629   0.628  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.317  -2.603  -1.360  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.871  -1.058  -2.124  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.669  -2.364  -1.989  1.00  0.00           H  
HETATM   32  H   UNL     1       0.213   3.199  -0.772  1.00  0.00           H  
HETATM   33  H   UNL     1       4.433   0.634   1.267  1.00  0.00           H  
HETATM   34  H   UNL     1       3.360  -0.727   1.676  1.00  0.00           H  
HETATM   35  H   UNL     1       3.451  -1.506  -0.676  1.00  0.00           H  
HETATM   36  H   UNL     1       4.524  -0.145  -1.085  1.00  0.00           H  
HETATM   37  H   UNL     1       5.187  -3.078  -1.353  1.00  0.00           H  
HETATM   38  H   UNL     1       6.260  -1.718  -1.762  1.00  0.00           H  
HETATM   39  H   UNL     1       6.803  -2.966  -0.615  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.053   2.700   0.079  1.00  0.00           H  
HETATM   41  H   UNL     1       6.083  -1.023   0.560  1.00  0.00           H  
CONECT    1    2   21   22   23                                       
CONECT    2    1    3   24   25                                       
CONECT    3    2    7    4    4                                       
CONECT    4    3    3   16   10                                       
CONECT    5    7    7    6   16                                       
CONECT    6    5   26   27   28                                       
CONECT    7    8    3    5    5                                       
CONECT    8    9   19   19    7                                       
CONECT    9    8   29   30   31                                       
CONECT   10    4   18   11   11                                       
CONECT   11   10   10   20   32                                       
CONECT   12   18   18   20   13                                       
CONECT   13   12   14   33   34                                       
CONECT   14   13   17   35   36                                       
CONECT   15   17   37   38   39                                       
CONECT   16    5    4   40                                            
CONECT   17   14   15   41                                            
CONECT   18   10   12   12                                            
CONECT   19    8    8                                                 
CONECT   20   11   12                                                 
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    2                                                      
CONECT   26    6                                                      
CONECT   27    6                                                      
CONECT   28    6                                                      
CONECT   29    9                                                      
CONECT   30    9                                                      
CONECT   31    9                                                      
CONECT   32   11                                                      
CONECT   33   13                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
