COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.464   0.912  -1.215  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.761   1.620  -0.090  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.547  -0.687   0.618  1.00  0.00           C  
HETATM    4  C   UNL     1       1.416  -1.158   0.184  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.778  -2.243   0.164  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.697   0.177  -0.199  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.049   0.823  -1.428  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.264   1.860   0.114  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.043  -0.517   0.843  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.506   0.549  -0.116  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.166  -0.039  -0.457  1.00  0.00           C  
HETATM   12  C   UNL     1       2.040  -0.496  -1.049  1.00  0.00           C  
HETATM   13  N   UNL     1      -7.226   0.594   0.851  1.00  0.00           N  
HETATM   14  N   UNL     1      -3.078   0.758   0.135  1.00  0.00           N  
HETATM   15  N   UNL     1       3.497  -0.412  -0.876  1.00  0.00           N  
HETATM   16  N   UNL     1      -0.046  -1.116   0.054  1.00  0.00           N  
HETATM   17  O   UNL     1       5.483   1.120   1.826  1.00  0.00           O  
HETATM   18  O   UNL     1      -0.225  -3.317   0.274  1.00  0.00           O  
HETATM   19  O   UNL     1      -2.528  -0.929  -1.196  1.00  0.00           O  
HETATM   20  O   UNL     1       5.873   1.504  -0.467  1.00  0.00           O  
HETATM   21  O   UNL     1       5.908  -0.750   0.222  1.00  0.00           O  
HETATM   22  O   UNL     1       3.840   0.377   0.307  1.00  0.00           O  
HETATM   23  S   UNL     1       5.336   0.508   0.551  1.00  0.00           S  
HETATM   24  H   UNL     1       1.924   1.393  -2.077  1.00  0.00           H  
HETATM   25  H   UNL     1       1.670   1.497  -0.318  1.00  0.00           H  
HETATM   26  H   UNL     1      -7.305   2.548   0.087  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.940   1.284  -1.111  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.726  -1.013  -0.406  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.935  -1.435   1.310  1.00  0.00           H  
HETATM   30  H   UNL     1       1.748  -2.194   0.250  1.00  0.00           H  
HETATM   31  H   UNL     1       1.721  -0.618   1.081  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.856  -2.190   0.154  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.569   0.827   0.666  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.456   1.824  -1.569  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.258   0.217  -2.310  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.915   2.611  -0.595  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.086   2.209   1.131  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.862  -0.205   1.872  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.537  -1.464   0.655  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.652   0.220  -1.145  1.00  0.00           H  
HETATM   41  H   UNL     1       1.812  -1.089  -1.934  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.107   0.897   1.806  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.789   1.471   0.726  1.00  0.00           H  
HETATM   44  H   UNL     1       3.938  -0.036  -1.702  1.00  0.00           H  
HETATM   45  H   UNL     1       6.825   1.662  -0.398  1.00  0.00           H  
CONECT    1    7   12   24   25                                       
CONECT    2    8   13   26   27                                       
CONECT    3   13    9   28   29                                       
CONECT    4   16   12   30   31                                       
CONECT    5   18   18   16   32                                       
CONECT    6    7   11   16   33                                       
CONECT    7    6    1   34   35                                       
CONECT    8    2   10   36   37                                       
CONECT    9   10    3   38   39                                       
CONECT   10    8    9   14   40                                       
CONECT   11   14    6   19   19                                       
CONECT   12   15    1    4   41                                       
CONECT   13    2    3   42                                            
CONECT   14   10   11   43                                            
CONECT   15   22   12   44                                            
CONECT   16    6    5    4                                            
CONECT   17   23   23                                                 
CONECT   18    5    5                                                 
CONECT   19   11   11                                                 
CONECT   20   23   45                                                 
CONECT   21   23   23                                                 
CONECT   22   23   15                                                 
CONECT   23   21   21   17   17                                       
CONECT   23   20   22                                                 
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   20                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
