COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.646   0.378   0.352  1.00  0.00           C  
HETATM    2  N   UNL     1       2.571  -1.070   0.605  1.00  0.00           N  
HETATM    3  C   UNL     1       3.298  -1.680  -0.387  1.00  0.00           C  
HETATM    4  N   UNL     1       3.831  -0.757  -1.252  1.00  0.00           N  
HETATM    5  C   UNL     1       3.497   0.498  -0.894  1.00  0.00           C  
HETATM    6  C   UNL     1       3.315   1.093   1.527  1.00  0.00           C  
HETATM    7  O   UNL     1       3.816   1.522  -1.459  1.00  0.00           O  
HETATM    8  C   UNL     1       1.270   0.941   0.105  1.00  0.00           C  
HETATM    9  C   UNL     1       0.160   0.132   0.240  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.111   0.654   0.013  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.255   1.992  -0.350  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.138   2.792  -0.482  1.00  0.00           C  
HETATM   13  C   UNL     1       1.122   2.270  -0.250  1.00  0.00           C  
HETATM   14  N   UNL     1       3.461  -2.967  -0.493  1.00  0.00           N  
HETATM   15  C   UNL     1       4.657  -1.093  -2.415  1.00  0.00           C  
HETATM   16  C   UNL     1       4.698   0.600   1.959  1.00  0.00           C  
HETATM   17  C   UNL     1       3.475   0.310   2.832  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.309  -0.211   0.156  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.585   0.304  -0.070  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.679  -0.553   0.078  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.453  -1.881   0.443  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.173  -1.552   0.512  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.011  -0.076  -0.142  1.00  0.00           C  
HETATM   24  N   UNL     1      -3.230  -2.327   0.647  1.00  0.00           N  
HETATM   25  C   UNL     1      -7.103   0.315  -0.322  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.473   0.806  -0.547  1.00  0.00           C  
HETATM   27  H   UNL     1       3.116   2.162   1.603  1.00  0.00           H  
HETATM   28  H   UNL     1       0.277  -0.904   0.521  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.238   2.402  -0.528  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.248   3.829  -0.763  1.00  0.00           H  
HETATM   31  H   UNL     1       1.993   2.899  -0.354  1.00  0.00           H  
HETATM   32  H   UNL     1       3.988  -3.331  -1.222  1.00  0.00           H  
HETATM   33  H   UNL     1       4.774  -2.175  -2.477  1.00  0.00           H  
HETATM   34  H   UNL     1       4.174  -0.727  -3.321  1.00  0.00           H  
HETATM   35  H   UNL     1       5.637  -0.627  -2.312  1.00  0.00           H  
HETATM   36  H   UNL     1       5.130  -0.234   1.406  1.00  0.00           H  
HETATM   37  H   UNL     1       5.408   1.344   2.319  1.00  0.00           H  
HETATM   38  H   UNL     1       3.380   0.863   3.766  1.00  0.00           H  
HETATM   39  H   UNL     1       3.103  -0.715   2.853  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.724   1.337  -0.352  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.292  -2.552   0.561  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.189  -1.959   0.689  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.181  -0.007  -0.384  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.686   1.619   0.146  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.565   1.167  -1.571  1.00  0.00           H  
HETATM   46  H   UNL     1       2.100  -1.508   1.332  1.00  0.00           H  
CONECT    1    8    6    2    5                                       
CONECT    2    1    3   46                                            
CONECT    3    2    4   14   14                                       
CONECT    4    5    3   15                                            
CONECT    5    1    7    7    4                                       
CONECT    6   17    1   16   27                                       
CONECT    7    5    5                                                 
CONECT    8   13   13    9    1                                       
CONECT    9   10   10    8   28                                       
CONECT   10   11   18    9    9                                       
CONECT   11   12   12   10   29                                       
CONECT   12   11   11   13   30                                       
CONECT   13   12    8    8   31                                       
CONECT   14    3    3   32                                            
CONECT   15    4   33   34   35                                       
CONECT   16   17    6   36   37                                       
CONECT   17    6   16   38   39                                       
CONECT   18   22   10   19   19                                       
CONECT   19   18   18   20   40                                       
CONECT   20   21   21   19   23                                       
CONECT   21   24   20   20   41                                       
CONECT   22   24   24   18   42                                       
CONECT   23   20   25   25   25                                       
CONECT   24   22   22   21                                            
CONECT   25   23   23   23   26                                       
CONECT   26   25   43   44   45                                       
CONECT   27    6                                                      
CONECT   28    9                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   19                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   26                                                      
CONECT   44   26                                                      
CONECT   45   26                                                      
CONECT   46    2                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
