COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.342   3.878  -1.319  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.144   3.282   0.076  1.00  0.00           C  
HETATM    3  O   UNL     1      -1.991   3.957   1.008  1.00  0.00           O  
HETATM    4  C   UNL     1      -1.493   1.816   0.050  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.590   0.797   0.034  1.00  0.00           N  
HETATM    6  C   UNL     1      -1.297  -0.378   0.013  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.655  -0.019   0.017  1.00  0.00           C  
HETATM    8  N   UNL     1      -2.703   1.337   0.046  1.00  0.00           N  
HETATM    9  C   UNL     1      -3.621  -1.031  -0.001  1.00  0.00           C  
HETATM   10  N   UNL     1      -3.276  -2.298  -0.023  1.00  0.00           N  
HETATM   11  C   UNL     1      -2.005  -2.692  -0.028  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.971  -1.742  -0.011  1.00  0.00           C  
HETATM   13  C   UNL     1       0.281  -2.497  -0.022  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.049  -3.799  -0.045  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.411  -3.932  -0.050  1.00  0.00           N  
HETATM   16  C   UNL     1       0.869   0.932   0.037  1.00  0.00           C  
HETATM   17  C   UNL     1       1.442   0.240   1.276  1.00  0.00           C  
HETATM   18  C   UNL     1       2.966   0.381   1.279  1.00  0.00           C  
HETATM   19  C   UNL     1       3.541  -0.270   0.019  1.00  0.00           C  
HETATM   20  C   UNL     1       2.968   0.422  -1.219  1.00  0.00           C  
HETATM   21  C   UNL     1       1.444   0.281  -1.223  1.00  0.00           C  
HETATM   22  C   UNL     1       5.007  -0.135   0.023  1.00  0.00           C  
HETATM   23  N   UNL     1       6.138  -0.030   0.025  1.00  0.00           N  
HETATM   24  H   UNL     1      -2.382   3.758  -1.621  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.089   4.938  -1.300  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.696   3.363  -2.029  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.104   3.402   0.379  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.934   3.892   0.801  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.668  -0.766   0.003  1.00  0.00           H  
HETATM   30  H   UNL     1       1.280  -2.087  -0.014  1.00  0.00           H  
HETATM   31  H   UNL     1       0.655  -4.618  -0.059  1.00  0.00           H  
HETATM   32  H   UNL     1       1.137   1.988   0.055  1.00  0.00           H  
HETATM   33  H   UNL     1       1.033   0.703   2.173  1.00  0.00           H  
HETATM   34  H   UNL     1       1.175  -0.817   1.258  1.00  0.00           H  
HETATM   35  H   UNL     1       3.233   1.437   1.297  1.00  0.00           H  
HETATM   36  H   UNL     1       3.374  -0.112   2.161  1.00  0.00           H  
HETATM   37  H   UNL     1       3.274  -1.327   0.002  1.00  0.00           H  
HETATM   38  H   UNL     1       3.235   1.479  -1.201  1.00  0.00           H  
HETATM   39  H   UNL     1       3.378  -0.041  -2.116  1.00  0.00           H  
HETATM   40  H   UNL     1       1.177  -0.775  -1.240  1.00  0.00           H  
HETATM   41  H   UNL     1       1.036   0.774  -2.105  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.887  -4.777  -0.065  1.00  0.00           H  
CONECT    1    2   24   25   26                                       
CONECT    2    3    4    1   27                                       
CONECT    3    2   28                                                 
CONECT    4    8    8    2    5                                       
CONECT    5    4    6   16                                            
CONECT    6    7    7    5   12                                       
CONECT    7    9    8    6    6                                       
CONECT    8    7    4    4                                            
CONECT    9    7   10   10   29                                       
CONECT   10    9    9   11                                            
CONECT   11   10   12   12   15                                       
CONECT   12   11   11    6   13                                       
CONECT   13   12   14   14   30                                       
CONECT   14   15   13   13   31                                       
CONECT   15   11   14   42                                            
CONECT   16   17    5   21   32                                       
CONECT   17   18   16   33   34                                       
CONECT   18   17   19   35   36                                       
CONECT   19   18   22   20   37                                       
CONECT   20   19   21   38   39                                       
CONECT   21   16   20   40   41                                       
CONECT   22   19   23   23   23                                       
CONECT   23   22   22   22                                            
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    9                                                      
CONECT   30   13                                                      
CONECT   31   14                                                      
CONECT   32   16                                                      
CONECT   33   17                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42   15                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
