COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.214   0.412   0.166  1.00  0.00           C  
HETATM    2  N   UNL     1      -0.261   1.255  -0.279  1.00  0.00           N  
HETATM    3  C   UNL     1       1.086   0.880  -0.225  1.00  0.00           C  
HETATM    4  C   UNL     1       3.391   1.457   0.097  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.251   0.737  -0.561  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.583   0.737  -0.927  1.00  0.00           C  
HETATM    7  C   UNL     1      -9.592  -1.217  -0.183  1.00  0.00           C  
HETATM    8  O   UNL     1      -8.759  -0.211  -0.762  1.00  0.00           O  
HETATM    9  C   UNL     1      -7.448  -0.212  -0.402  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.974  -1.162   0.491  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.643  -1.162   0.858  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.779  -0.213   0.333  1.00  0.00           C  
HETATM   13  O   UNL     1      -3.467  -0.214   0.693  1.00  0.00           O  
HETATM   14  C   UNL     1      -2.655   0.849   0.190  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.802   2.075   1.094  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.911  -0.701   0.543  1.00  0.00           O  
HETATM   17  C   UNL     1       2.063   1.830   0.044  1.00  0.00           C  
HETATM   18  C   UNL     1       3.750   0.138  -0.117  1.00  0.00           C  
HETATM   19  C   UNL     1       2.779  -0.812  -0.380  1.00  0.00           C  
HETATM   20  C   UNL     1       1.449  -0.444  -0.434  1.00  0.00           C  
HETATM   21  I   UNL     1       5.768  -0.421  -0.045  1.00  0.00           I  
HETATM   22  H   UNL     1      -0.509   2.121  -0.637  1.00  0.00           H  
HETATM   23  H   UNL     1       4.151   2.196   0.302  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.577   1.473  -0.973  1.00  0.00           H  
HETATM   25  H   UNL     1      -6.951   1.477  -1.623  1.00  0.00           H  
HETATM   26  H   UNL     1      -9.586  -1.112   0.902  1.00  0.00           H  
HETATM   27  H   UNL     1     -10.610  -1.103  -0.553  1.00  0.00           H  
HETATM   28  H   UNL     1      -9.214  -2.203  -0.454  1.00  0.00           H  
HETATM   29  H   UNL     1      -7.647  -1.901   0.900  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.275  -1.901   1.554  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.975   1.103  -0.821  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.845   2.391   1.112  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.482   1.820   2.105  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.182   2.885   0.711  1.00  0.00           H  
HETATM   35  H   UNL     1       1.783   2.860   0.211  1.00  0.00           H  
HETATM   36  H   UNL     1       3.062  -1.840  -0.547  1.00  0.00           H  
HETATM   37  H   UNL     1       0.691  -1.186  -0.639  1.00  0.00           H  
CONECT    1   14   16   16    2                                       
CONECT    2    1    3   22                                            
CONECT    3    2   20   20   17                                       
CONECT    4   17   17   18   23                                       
CONECT    5   12   12    6   24                                       
CONECT    6    5    9    9   25                                       
CONECT    7    8   26   27   28                                       
CONECT    8    9    7                                                 
CONECT    9    6    6    8   10                                       
CONECT   10   11   11    9   29                                       
CONECT   11   12   10   10   30                                       
CONECT   12   13    5    5   11                                       
CONECT   13   14   12                                                 
CONECT   14   15   13    1   31                                       
CONECT   15   14   32   33   34                                       
CONECT   16    1    1                                                 
CONECT   17    3    4    4   35                                       
CONECT   18   19   19    4   21                                       
CONECT   19   20   18   18   36                                       
CONECT   20    3    3   19   37                                       
CONECT   21   18                                                      
CONECT   22    2                                                      
CONECT   23    4                                                      
CONECT   24    5                                                      
CONECT   25    6                                                      
CONECT   26    7                                                      
CONECT   27    7                                                      
CONECT   28    7                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   14                                                      
CONECT   32   15                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   17                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
