COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.604   0.770  -0.077  1.00  0.00           C  
HETATM    2  C   UNL     1       0.853  -1.909  -0.100  1.00  0.00           C  
HETATM    3  C   UNL     1       0.040  -2.904   1.932  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.150  -2.218   1.797  1.00  0.00           C  
HETATM    5  C   UNL     1       2.498   0.863  -0.506  1.00  0.00           C  
HETATM    6  C   UNL     1       1.793   2.486   1.107  1.00  0.00           C  
HETATM    7  C   UNL     1       3.109   2.685   1.482  1.00  0.00           C  
HETATM    8  C   UNL     1       3.814   1.062  -0.131  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.590   1.639  -0.646  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.753   0.062   1.082  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.674  -0.708   1.425  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.626  -0.643   0.555  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.352  -1.377   0.701  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.341  -1.221  -0.247  1.00  0.00           C  
HETATM   15  C   UNL     1       1.040  -2.752   0.990  1.00  0.00           C  
HETATM   16  C   UNL     1       2.337  -3.504   1.144  1.00  0.00           C  
HETATM   17  C   UNL     1       1.488   1.575   0.113  1.00  0.00           C  
HETATM   18  C   UNL     1       4.119   1.973   0.863  1.00  0.00           C  
HETATM   19  C   UNL     1       3.442   3.680   2.563  1.00  0.00           C  
HETATM   20  N   UNL     1       1.867  -1.760  -1.050  1.00  0.00           N  
HETATM   21  N   UNL     1      -6.373   2.328  -1.097  1.00  0.00           N  
HETATM   22  O   UNL     1       0.854   0.104  -2.311  1.00  0.00           O  
HETATM   23  O   UNL     1       3.282  -0.427  -2.570  1.00  0.00           O  
HETATM   24  S   UNL     1      -3.020   0.447  -0.768  1.00  0.00           S  
HETATM   25  S   UNL     1       2.110  -0.293  -1.778  1.00  0.00           S  
HETATM   26  H   UNL     1       0.191  -3.560   2.776  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.929  -2.339   2.536  1.00  0.00           H  
HETATM   28  H   UNL     1       1.004   3.043   1.590  1.00  0.00           H  
HETATM   29  H   UNL     1       4.603   0.506  -0.614  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.651   0.106   1.681  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.654  -1.319   2.316  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.488  -0.565  -1.092  1.00  0.00           H  
HETATM   33  H   UNL     1       3.040  -2.902   1.720  1.00  0.00           H  
HETATM   34  H   UNL     1       2.152  -4.444   1.663  1.00  0.00           H  
HETATM   35  H   UNL     1       2.757  -3.710   0.159  1.00  0.00           H  
HETATM   36  H   UNL     1       0.460   1.419  -0.180  1.00  0.00           H  
HETATM   37  H   UNL     1       5.147   2.129   1.155  1.00  0.00           H  
HETATM   38  H   UNL     1       3.433   3.180   3.532  1.00  0.00           H  
HETATM   39  H   UNL     1       4.431   4.099   2.380  1.00  0.00           H  
HETATM   40  H   UNL     1       2.702   4.481   2.561  1.00  0.00           H  
HETATM   41  H   UNL     1       2.428  -2.516  -1.283  1.00  0.00           H  
CONECT    1    9   10   10   24                                       
CONECT    2   14   14   15   20                                       
CONECT    3    4   15   15   26                                       
CONECT    4   13   13    3   27                                       
CONECT    5   25   17   17    8                                       
CONECT    6   17    7    7   28                                       
CONECT    7    6    6   18   19                                       
CONECT    8    5   18   18   29                                       
CONECT    9   21   21   21    1                                       
CONECT   10    1    1   11   30                                       
CONECT   11   10   12   12   31                                       
CONECT   12   24   11   11   13                                       
CONECT   13   12    4    4   14                                       
CONECT   14   13    2    2   32                                       
CONECT   15    3    3    2   16                                       
CONECT   16   15   33   34   35                                       
CONECT   17    5    5    6   36                                       
CONECT   18    8    8    7   37                                       
CONECT   19    7   38   39   40                                       
CONECT   20    2   25   41                                            
CONECT   21    9    9    9                                            
CONECT   22   25   25                                                 
CONECT   23   25   25                                                 
CONECT   24    1   12                                                 
CONECT   25   22   22   20   23                                       
CONECT   25   23    5                                                 
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    6                                                      
CONECT   29    8                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   14                                                      
CONECT   33   16                                                      
CONECT   34   16                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   19                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
