COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.684  -0.306   0.189  1.00  0.00           C  
HETATM    2  C   UNL     1       4.583  -1.585   0.757  1.00  0.00           C  
HETATM    3  C   UNL     1       5.703  -2.346   0.908  1.00  0.00           C  
HETATM    4  C   UNL     1       6.950  -1.874   0.505  1.00  0.00           C  
HETATM    5  C   UNL     1       7.085  -0.638  -0.050  1.00  0.00           C  
HETATM    6  C   UNL     1       5.952   0.175  -0.221  1.00  0.00           C  
HETATM    7  C   UNL     1       6.055   1.456  -0.792  1.00  0.00           C  
HETATM    8  C   UNL     1       4.940   2.223  -0.946  1.00  0.00           C  
HETATM    9  C   UNL     1       3.689   1.761  -0.547  1.00  0.00           C  
HETATM   10  C   UNL     1       3.545   0.509   0.012  1.00  0.00           C  
HETATM   11  N   UNL     1       2.287   0.054   0.402  1.00  0.00           N  
HETATM   12  C   UNL     1       1.179   0.554  -0.179  1.00  0.00           C  
HETATM   13  O   UNL     1       1.278   1.326  -1.111  1.00  0.00           O  
HETATM   14  C   UNL     1      -0.171   0.159   0.323  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.270  -0.613   1.254  1.00  0.00           O  
HETATM   16  N   UNL     1      -1.279   0.659  -0.259  1.00  0.00           N  
HETATM   17  C   UNL     1      -2.603   0.272   0.234  1.00  0.00           C  
HETATM   18  O   UNL     1      -3.101  -0.819  -0.544  1.00  0.00           O  
HETATM   19  C   UNL     1      -4.382  -1.295  -0.129  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.799  -2.474  -1.011  1.00  0.00           C  
HETATM   21  O   UNL     1      -3.903  -3.567  -0.799  1.00  0.00           O  
HETATM   22  C   UNL     1      -5.411  -0.169  -0.263  1.00  0.00           C  
HETATM   23  O   UNL     1      -6.682  -0.625   0.206  1.00  0.00           O  
HETATM   24  C   UNL     1      -4.957   1.030   0.575  1.00  0.00           C  
HETATM   25  O   UNL     1      -5.873   2.112   0.398  1.00  0.00           O  
HETATM   26  C   UNL     1      -3.560   1.460   0.115  1.00  0.00           C  
HETATM   27  O   UNL     1      -3.096   2.532   0.938  1.00  0.00           O  
HETATM   28  H   UNL     1       3.623  -1.963   1.074  1.00  0.00           H  
HETATM   29  H   UNL     1       5.622  -3.330   1.345  1.00  0.00           H  
HETATM   30  H   UNL     1       7.822  -2.497   0.636  1.00  0.00           H  
HETATM   31  H   UNL     1       8.059  -0.284  -0.356  1.00  0.00           H  
HETATM   32  H   UNL     1       7.017   1.832  -1.107  1.00  0.00           H  
HETATM   33  H   UNL     1       5.028   3.206  -1.385  1.00  0.00           H  
HETATM   34  H   UNL     1       2.821   2.390  -0.680  1.00  0.00           H  
HETATM   35  H   UNL     1       2.209  -0.623   1.093  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.200   1.276  -1.003  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.528  -0.031   1.278  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.331  -1.618   0.910  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.813  -2.780  -0.753  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.765  -2.174  -2.058  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.107  -4.351  -1.327  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.493   0.127  -1.309  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.383   0.039   0.150  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.924   0.748   1.627  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.646   2.906   0.900  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.604   1.790  -0.924  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.213   2.853   0.705  1.00  0.00           H  
CONECT    1    2    2    6   10                                       
CONECT    2    1    1    3   28                                       
CONECT    3    2    4    4   29                                       
CONECT    4    3    3    5   30                                       
CONECT    5    4    6    6   31                                       
CONECT    6    1    5    5    7                                       
CONECT    7    6    8    8   32                                       
CONECT    8    7    7    9   33                                       
CONECT    9    8   10   10   34                                       
CONECT   10    1    9    9   11                                       
CONECT   11   10   12   35                                            
CONECT   12   11   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   15   16                                       
CONECT   15   14   14                                                 
CONECT   16   14   17   36                                            
CONECT   17   16   18   26   37                                       
CONECT   18   17   19                                                 
CONECT   19   18   20   22   38                                       
CONECT   20   19   21   39   40                                       
CONECT   21   20   41                                                 
CONECT   22   19   23   24   42                                       
CONECT   23   22   43                                                 
CONECT   24   22   25   26   44                                       
CONECT   25   24   45                                                 
CONECT   26   17   24   27   46                                       
CONECT   27   26   47                                                 
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   27                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
