COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.696   1.600   0.061  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.927  -2.514   0.080  1.00  0.00           C  
HETATM    3  C   UNL     1       2.720   2.570   0.147  1.00  0.00           C  
HETATM    4  C   UNL     1       1.366   2.237   0.170  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.084  -0.421   0.111  1.00  0.00           C  
HETATM    6  C   UNL     1       4.053  -1.018  -0.105  1.00  0.00           C  
HETATM    7  C   UNL     1       1.872  -1.540  -0.049  1.00  0.00           C  
HETATM    8  C   UNL     1       0.733  -2.276  -0.044  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.646  -1.750   0.027  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.443  -0.154   0.177  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.364  -1.199   0.162  1.00  0.00           C  
HETATM   12  N   UNL     1       3.165  -2.034  -0.129  1.00  0.00           N  
HETATM   13  C   UNL     1       3.330   0.254  -0.004  1.00  0.00           C  
HETATM   14  C   UNL     1       0.981   0.904   0.108  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.577  -2.792   0.013  1.00  0.00           C  
HETATM   16  C   UNL     1       3.516  -3.453  -0.226  1.00  0.00           C  
HETATM   17  C   UNL     1       0.895   4.562   0.316  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.136   1.809  -0.975  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.614   3.233  -0.686  1.00  0.00           C  
HETATM   20  C   UNL     1       1.963  -0.074   0.028  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.583  -2.049   0.209  1.00  0.00           C  
HETATM   22  O   UNL     1      -0.368   0.737   0.140  1.00  0.00           O  
HETATM   23  O   UNL     1       5.264  -1.138  -0.158  1.00  0.00           O  
HETATM   24  O   UNL     1       0.426   3.214   0.255  1.00  0.00           O  
HETATM   25  O   UNL     1      -2.879   1.133   0.257  1.00  0.00           O  
HETATM   26  O   UNL     1      -4.694  -0.931   0.228  1.00  0.00           O  
HETATM   27  H   UNL     1       4.739   1.880   0.039  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.645  -3.321   0.069  1.00  0.00           H  
HETATM   29  H   UNL     1       3.010   3.609   0.197  1.00  0.00           H  
HETATM   30  H   UNL     1       0.844  -3.349  -0.110  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.240  -3.816  -0.052  1.00  0.00           H  
HETATM   32  H   UNL     1       4.600  -3.557  -0.275  1.00  0.00           H  
HETATM   33  H   UNL     1       3.140  -3.982   0.650  1.00  0.00           H  
HETATM   34  H   UNL     1       3.070  -3.877  -1.126  1.00  0.00           H  
HETATM   35  H   UNL     1       0.044   5.240   0.381  1.00  0.00           H  
HETATM   36  H   UNL     1       1.527   4.687   1.195  1.00  0.00           H  
HETATM   37  H   UNL     1       1.471   4.787  -0.581  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.907   1.272  -1.529  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.222   1.845  -1.567  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.811   3.748  -1.626  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.529   3.196  -0.094  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.844   3.769  -0.132  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.443  -2.609  -0.716  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.372  -2.696   1.060  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.613  -1.696   0.267  1.00  0.00           H  
CONECT    1    3   13   13   27                                       
CONECT    2   11   11   15   28                                       
CONECT    3    4    4    1   29                                       
CONECT    4   24    3    3   14                                       
CONECT    5   22   10   10    9                                       
CONECT    6   13   23   23   12                                       
CONECT    7   20   12    8    8                                       
CONECT    8    7    7    9   30                                       
CONECT    9    5    8   15   15                                       
CONECT   10   25    5    5   11                                       
CONECT   11   10   26    2    2                                       
CONECT   12    6    7   16                                            
CONECT   13    1    1   20    6                                       
CONECT   14    4   22   20   20                                       
CONECT   15    9    9    2   31                                       
CONECT   16   12   32   33   34                                       
CONECT   17   24   35   36   37                                       
CONECT   18   19   25   38   39                                       
CONECT   19   18   40   41   42                                       
CONECT   20   14   14   13    7                                       
CONECT   21   26   43   44   45                                       
CONECT   22   14    5                                                 
CONECT   23    6    6                                                 
CONECT   24   17    4                                                 
CONECT   25   18   10                                                 
CONECT   26   11   21                                                 
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    8                                                      
CONECT   31   15                                                      
CONECT   32   16                                                      
CONECT   33   16                                                      
CONECT   34   16                                                      
CONECT   35   17                                                      
CONECT   36   17                                                      
CONECT   37   17                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
