COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.261  -2.201   8.892  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.086  -1.749   9.539  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.056  -2.152   8.743  1.00  0.00           C  
HETATM    4  O   UNL     1      -4.489  -2.817   7.654  1.00  0.00           O  
HETATM    5  C   UNL     1      -5.844  -2.845   7.750  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.559  -3.527   6.662  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.744  -1.767   8.019  1.00  0.00           C  
HETATM    8  S   UNL     1      -2.038  -1.786   6.331  1.00  0.00           S  
HETATM    9  C   UNL     1      -0.330  -1.505   6.038  1.00  0.00           C  
HETATM   10  N   UNL     1       0.102  -1.413   4.700  1.00  0.00           N  
HETATM   11  S   UNL     1       1.754  -1.149   4.420  1.00  0.00           S  
HETATM   12  C   UNL     1       1.860   0.585   4.599  1.00  0.00           C  
HETATM   13  C   UNL     1       1.681   1.413   3.491  1.00  0.00           C  
HETATM   14  C   UNL     1       1.766   2.798   3.633  1.00  0.00           C  
HETATM   15  C   UNL     1       2.030   3.355   4.885  1.00  0.00           C  
HETATM   16  C   UNL     1       2.210   2.527   5.993  1.00  0.00           C  
HETATM   17  C   UNL     1       2.125   1.142   5.850  1.00  0.00           C  
HETATM   18  C   UNL     1       2.121   4.835   5.037  1.00  0.00           C  
HETATM   19  O   UNL     1       2.525  -1.765   5.492  1.00  0.00           O  
HETATM   20  O   UNL     1       2.062  -1.484   3.035  1.00  0.00           O  
HETATM   21  C   UNL     1      -0.300  -1.538   8.282  1.00  0.00           C  
HETATM   22  N   UNL     1       0.407  -1.404   7.102  1.00  0.00           N  
HETATM   23  O   UNL     1       0.178  -1.481   9.407  1.00  0.00           O  
HETATM   24  C   UNL     1      -2.657  -1.931   8.977  1.00  0.00           C  
HETATM   25  H   UNL     1       1.246   5.320   4.587  1.00  0.00           H  
HETATM   26  H   UNL     1       2.174   5.124   6.095  1.00  0.00           H  
HETATM   27  H   UNL     1       3.024   5.231   4.555  1.00  0.00           H  
HETATM   28  H   UNL     1       2.417   2.952   6.971  1.00  0.00           H  
HETATM   29  H   UNL     1       2.267   0.506   6.720  1.00  0.00           H  
HETATM   30  H   UNL     1       1.473   0.989   2.511  1.00  0.00           H  
HETATM   31  H   UNL     1       1.624   3.435   2.765  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.587  -1.512   3.947  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.322  -1.864  10.013  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.023  -1.199  10.468  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.283  -2.072   9.220  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.529  -3.929   7.006  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.765  -2.854   5.809  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.981  -4.372   6.245  1.00  0.00           H  
CONECT    1    2    5    5   35                                       
CONECT    2    1    3    3   34                                       
CONECT    3    2    2   24    4                                       
CONECT    4    3    5                                                 
CONECT    5    1    1    4    6                                       
CONECT    6    5   36   37   38                                       
CONECT    7   21   24   24    8                                       
CONECT    8    7    9                                                 
CONECT    9    8   10   22   22                                       
CONECT   10    9   11   32                                            
CONECT   11   10   12   19   19                                       
CONECT   11   20   20                                                 
CONECT   12   11   17   17   13                                       
CONECT   13   12   14   14   30                                       
CONECT   14   13   13   15   31                                       
CONECT   15   14   18   16   16                                       
CONECT   16   15   15   17   28                                       
CONECT   17   12   12   16   29                                       
CONECT   18   15   25   26   27                                       
CONECT   19   11   11                                                 
CONECT   20   11   11                                                 
CONECT   21    7   22   23   23                                       
CONECT   22    9    9   21                                            
CONECT   23   21   21                                                 
CONECT   24    3    7    7   33                                       
CONECT   25   18                                                      
CONECT   26   18                                                      
CONECT   27   18                                                      
CONECT   28   16                                                      
CONECT   29   17                                                      
CONECT   30   13                                                      
CONECT   31   14                                                      
CONECT   32   10                                                      
CONECT   33   24                                                      
CONECT   34    2                                                      
CONECT   35    1                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
MASTER        0    0    0    0    0    0    0    0   38    0   38    0
END
