COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.355  -0.273  -1.282  1.00  0.00           C  
HETATM    2  C   UNL     1       8.111   0.529  -0.002  1.00  0.00           C  
HETATM    3  C   UNL     1       8.370  -0.362   1.215  1.00  0.00           C  
HETATM    4  C   UNL     1       9.056   1.731   0.035  1.00  0.00           C  
HETATM    5  O   UNL     1       6.735   0.994   0.022  1.00  0.00           O  
HETATM    6  C   UNL     1       5.772   0.054  -0.005  1.00  0.00           C  
HETATM    7  O   UNL     1       6.072  -1.123  -0.049  1.00  0.00           O  
HETATM    8  N   UNL     1       4.474   0.418   0.015  1.00  0.00           N  
HETATM    9  C   UNL     1       3.426  -0.605  -0.015  1.00  0.00           C  
HETATM   10  C   UNL     1       2.053   0.071   0.017  1.00  0.00           C  
HETATM   11  C   UNL     1       0.958  -0.997  -0.015  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.414  -0.322   0.017  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.437  -1.319  -0.012  1.00  0.00           O  
HETATM   14  C   UNL     1      -2.724  -0.884   0.011  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.997   0.475   0.054  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.307   0.915   0.077  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.344   0.002   0.057  1.00  0.00           C  
HETATM   18  S   UNL     1      -7.013   0.566   0.086  1.00  0.00           S  
HETATM   19  O   UNL     1      -7.790  -0.505   0.604  1.00  0.00           O  
HETATM   20  O   UNL     1      -6.989   1.861   0.670  1.00  0.00           O  
HETATM   21  N   UNL     1      -7.489   0.772  -1.487  1.00  0.00           N  
HETATM   22  C   UNL     1      -5.075  -1.353   0.013  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.767  -1.798  -0.016  1.00  0.00           C  
HETATM   24  H   UNL     1       9.388  -0.623  -1.300  1.00  0.00           H  
HETATM   25  H   UNL     1       7.681  -1.130  -1.308  1.00  0.00           H  
HETATM   26  H   UNL     1       8.171   0.361  -2.149  1.00  0.00           H  
HETATM   27  H   UNL     1       9.402  -0.711   1.197  1.00  0.00           H  
HETATM   28  H   UNL     1       8.195   0.210   2.127  1.00  0.00           H  
HETATM   29  H   UNL     1       7.696  -1.218   1.189  1.00  0.00           H  
HETATM   30  H   UNL     1       8.872   2.365  -0.832  1.00  0.00           H  
HETATM   31  H   UNL     1       8.882   2.302   0.947  1.00  0.00           H  
HETATM   32  H   UNL     1      10.089   1.382   0.017  1.00  0.00           H  
HETATM   33  H   UNL     1       4.235   1.357   0.050  1.00  0.00           H  
HETATM   34  H   UNL     1       3.519  -1.194  -0.927  1.00  0.00           H  
HETATM   35  H   UNL     1       3.530  -1.257   0.852  1.00  0.00           H  
HETATM   36  H   UNL     1       1.960   0.660   0.929  1.00  0.00           H  
HETATM   37  H   UNL     1       1.052  -1.587  -0.927  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.508   0.268   0.929  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.518   0.331  -0.850  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.187   1.189   0.071  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.520   1.974   0.111  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.420   0.650  -1.732  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.837   1.014  -2.163  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.887  -2.065  -0.004  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.557  -2.857  -0.054  1.00  0.00           H  
HETATM   46  H   UNL     1       1.949   0.723  -0.850  1.00  0.00           H  
HETATM   47  H   UNL     1       1.062  -1.650   0.852  1.00  0.00           H  
CONECT    1    2   24   25   26                                       
CONECT    2    1    3    4    5                                       
CONECT    3    2   27   28   29                                       
CONECT    4    2   30   31   32                                       
CONECT    5    2    6                                                 
CONECT    6    7    7    5    8                                       
CONECT    7    6    6                                                 
CONECT    8    9    6   33                                            
CONECT    9   10    8   34   35                                       
CONECT   10   11    9   36   46                                       
CONECT   11   12   10   37   47                                       
CONECT   12   11   13   38   39                                       
CONECT   13   12   14                                                 
CONECT   14   13   23   23   15                                       
CONECT   15   14   16   16   40                                       
CONECT   16   15   15   17   41                                       
CONECT   17   22   22   16   18                                       
CONECT   18   17   21   20   20                                       
CONECT   18   19   19                                                 
CONECT   19   18   18                                                 
CONECT   20   18   18                                                 
CONECT   21   18   42   43                                            
CONECT   22   23   17   17   44                                       
CONECT   23   14   14   22   45                                       
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   10                                                      
CONECT   47   11                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
