COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.432  -0.263   8.426  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.909   0.388   7.288  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.110   0.475   6.148  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.832  -0.088   6.143  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.357  -0.739   7.283  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.156  -0.827   8.423  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.009   0.002   4.966  1.00  0.00           C  
HETATM    8  N   UNL     1      -2.154   0.955   4.664  1.00  0.00           N1+
HETATM    9  C   UNL     1      -1.495   0.789   3.467  1.00  0.00           C  
HETATM   10  S   UNL     1      -3.054  -1.200   3.751  1.00  0.00           S  
HETATM   11  C   UNL     1      -1.870  -0.373   2.804  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.307  -0.716   1.567  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.354   0.151   1.020  1.00  0.00           C  
HETATM   14  C   UNL     1       0.024   1.318   1.684  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.540   1.656   2.918  1.00  0.00           C  
HETATM   16  O   UNL     1       0.213  -0.152  -0.182  1.00  0.00           O  
HETATM   17  N   UNL     1      -6.240  -0.352   9.578  1.00  0.00           N  
HETATM   18  C   UNL     1      -7.684  -0.393   9.461  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.636  -0.417  10.894  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.930   2.092   5.531  1.00  0.00           C  
HETATM   21  H   UNL     1      -6.901   0.831   7.279  1.00  0.00           H  
HETATM   22  H   UNL     1      -5.495   0.986   5.269  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.365  -1.185   7.296  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.775  -1.336   9.305  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.600  -1.624   1.049  1.00  0.00           H  
HETATM   26  H   UNL     1       0.767   1.978   1.242  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.234   2.568   3.420  1.00  0.00           H  
HETATM   28  H   UNL     1       1.068  -0.589  -0.047  1.00  0.00           H  
HETATM   29  H   UNL     1      -8.145  -0.206  10.434  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.006  -1.374   9.101  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.028   0.369   8.756  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.222   0.171  11.606  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.618  -0.019  10.863  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.597  -1.453  11.241  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.404   2.868   4.968  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.882   2.488   5.895  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.326   1.787   6.391  1.00  0.00           H  
CONECT    1    2    6    6   17                                       
CONECT    2    1    3    3   21                                       
CONECT    3    2    2    4   22                                       
CONECT    4    3    5    5    7                                       
CONECT    5    4    4    6   23                                       
CONECT    6    1    1    5   24                                       
CONECT    7    4    8    8   10                                       
CONECT    8    7    7    9   20                                       
CONECT    9    8   11   15   15                                       
CONECT   10    7   11                                                 
CONECT   11    9   10   12   12                                       
CONECT   12   11   11   13   25                                       
CONECT   13   12   14   14   16                                       
CONECT   14   13   13   15   26                                       
CONECT   15    9    9   14   27                                       
CONECT   16   13   28                                                 
CONECT   17    1   18   19                                            
CONECT   18   17   29   30   31                                       
CONECT   19   17   32   33   34                                       
CONECT   20    8   35   36   37                                       
CONECT   21    2                                                      
CONECT   22    3                                                      
CONECT   23    5                                                      
CONECT   24    6                                                      
CONECT   25   12                                                      
CONECT   26   14                                                      
CONECT   27   15                                                      
CONECT   28   16                                                      
CONECT   29   18                                                      
CONECT   30   18                                                      
CONECT   31   18                                                      
CONECT   32   19                                                      
CONECT   33   19                                                      
CONECT   34   19                                                      
CONECT   35   20                                                      
CONECT   36   20                                                      
CONECT   37   20                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
