COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.524  -1.507   0.345  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.680  -2.209   0.619  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.912  -1.590   0.506  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.993  -0.265   0.117  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.843   0.447  -0.159  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.600  -0.171  -0.046  1.00  0.00           C  
HETATM    7  N   UNL     1      -2.100   0.114  -0.274  1.00  0.00           N  
HETATM    8  C   UNL     1      -3.361   0.589  -0.342  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.291   1.889  -0.731  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.267   1.061  -0.602  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.966   2.180  -0.894  1.00  0.00           N  
HETATM   12  C   UNL     1       0.234   0.929  -0.650  1.00  0.00           C  
HETATM   13  C   UNL     1       0.744   0.429   0.703  1.00  0.00           C  
HETATM   14  C   UNL     1       2.245   0.297   0.656  1.00  0.00           C  
HETATM   15  C   UNL     1       3.026   0.956   1.608  1.00  0.00           C  
HETATM   16  C   UNL     1       4.928   0.114   0.644  1.00  0.00           C  
HETATM   17  C   UNL     1       6.327  -0.014   0.594  1.00  0.00           C  
HETATM   18  C   UNL     1       6.900  -0.776  -0.377  1.00  0.00           C  
HETATM   19  C   UNL     1       6.120  -1.433  -1.327  1.00  0.00           C  
HETATM   20  C   UNL     1       4.763  -1.332  -1.310  1.00  0.00           C  
HETATM   21  C   UNL     1       4.134  -0.563  -0.316  1.00  0.00           C  
HETATM   22  N   UNL     1       4.336   0.855   1.586  1.00  0.00           N  
HETATM   23  N   UNL     1       2.803  -0.441  -0.276  1.00  0.00           N  
HETATM   24  H   UNL     1      -3.563  -1.990   0.438  1.00  0.00           H  
HETATM   25  H   UNL     1      -5.623  -3.244   0.923  1.00  0.00           H  
HETATM   26  H   UNL     1      -7.814  -2.144   0.721  1.00  0.00           H  
HETATM   27  H   UNL     1      -7.957   0.213   0.030  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.908   1.481  -0.462  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.123   2.561  -0.883  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.595   3.033  -1.168  1.00  0.00           H  
HETATM   31  H   UNL     1       0.512   0.219  -1.428  1.00  0.00           H  
HETATM   32  H   UNL     1       0.677   1.900  -0.869  1.00  0.00           H  
HETATM   33  H   UNL     1       0.466   1.139   1.482  1.00  0.00           H  
HETATM   34  H   UNL     1       0.301  -0.543   0.922  1.00  0.00           H  
HETATM   35  H   UNL     1       2.549   1.555   2.369  1.00  0.00           H  
HETATM   36  H   UNL     1       6.944   0.490   1.323  1.00  0.00           H  
HETATM   37  H   UNL     1       7.976  -0.872  -0.413  1.00  0.00           H  
HETATM   38  H   UNL     1       6.600  -2.031  -2.088  1.00  0.00           H  
HETATM   39  H   UNL     1       4.172  -1.847  -2.053  1.00  0.00           H  
CONECT    1    2    2    6   24                                       
CONECT    2    1    1    3   25                                       
CONECT    3    2    4    4   26                                       
CONECT    4    3    3    5   27                                       
CONECT    5    6    6    4   28                                       
CONECT    6    1    8    5    5                                       
CONECT    7   10   10    8                                            
CONECT    8    7    6    9    9                                       
CONECT    9   11    8    8   29                                       
CONECT   10   12    7    7   11                                       
CONECT   11   10    9   30                                            
CONECT   12   13   10   31   32                                       
CONECT   13   14   12   33   34                                       
CONECT   14   23   23   15   13                                       
CONECT   15   22   22   14   35                                       
CONECT   16   17   17   21   22                                       
CONECT   17   18   16   16   36                                       
CONECT   18   19   19   17   37                                       
CONECT   19   18   18   20   38                                       
CONECT   20   19   21   21   39                                       
CONECT   21   20   20   16   23                                       
CONECT   22   16   15   15                                            
CONECT   23   21   14   14                                            
CONECT   24    1                                                      
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    9                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   13                                                      
CONECT   35   15                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
