COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.095  -0.453  -0.618  1.00  0.00           C  
HETATM    2  C   UNL     1       4.058  -1.957  -0.686  1.00  0.00           C  
HETATM    3  C   UNL     1       2.992  -2.509   0.261  1.00  0.00           C  
HETATM    4  C   UNL     1       1.665  -1.789  -0.012  1.00  0.00           C  
HETATM    5  N   UNL     1       1.854  -0.366   0.303  1.00  0.00           N  
HETATM    6  C   UNL     1       3.017   0.277  -0.142  1.00  0.00           C  
HETATM    7  C   UNL     1       3.082   1.665  -0.098  1.00  0.00           C  
HETATM    8  C   UNL     1       4.220   2.318  -0.529  1.00  0.00           C  
HETATM    9  C   UNL     1       5.296   1.589  -1.002  1.00  0.00           C  
HETATM   10  C   UNL     1       5.232   0.209  -1.049  1.00  0.00           C  
HETATM   11  C   UNL     1       0.924   0.309   1.007  1.00  0.00           C  
HETATM   12  O   UNL     1       1.221   1.346   1.569  1.00  0.00           O  
HETATM   13  N   UNL     1      -0.335  -0.165   1.089  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.765  -1.295   0.254  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.030  -0.889  -0.510  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.088  -0.404   0.484  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.561   0.823   1.232  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.301   0.433   2.020  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.345  -0.036  -0.261  1.00  0.00           C  
HETATM   20  N   UNL     1      -5.631  -0.202   0.177  1.00  0.00           N  
HETATM   21  C   UNL     1      -6.447   0.258  -0.796  1.00  0.00           C  
HETATM   22  N   UNL     1      -5.715   0.688  -1.787  1.00  0.00           N  
HETATM   23  C   UNL     1      -4.419   0.524  -1.484  1.00  0.00           C  
HETATM   24  H   UNL     1       3.828  -2.266  -1.705  1.00  0.00           H  
HETATM   25  H   UNL     1       5.032  -2.354  -0.401  1.00  0.00           H  
HETATM   26  H   UNL     1       2.870  -3.578   0.089  1.00  0.00           H  
HETATM   27  H   UNL     1       3.296  -2.336   1.293  1.00  0.00           H  
HETATM   28  H   UNL     1       1.393  -1.902  -1.061  1.00  0.00           H  
HETATM   29  H   UNL     1       0.882  -2.207   0.621  1.00  0.00           H  
HETATM   30  H   UNL     1       2.241   2.233   0.271  1.00  0.00           H  
HETATM   31  H   UNL     1       4.271   3.396  -0.496  1.00  0.00           H  
HETATM   32  H   UNL     1       6.187   2.099  -1.337  1.00  0.00           H  
HETATM   33  H   UNL     1       6.075  -0.355  -1.419  1.00  0.00           H  
HETATM   34  H   UNL     1       0.024  -1.547  -0.454  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.981  -2.156   0.886  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.791  -0.087  -1.209  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.414  -1.749  -1.059  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.307  -1.198   1.197  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.318   1.609   0.517  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.324   1.182   1.923  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.560  -0.290   2.794  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.866   1.322   2.478  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.526   0.268  -0.759  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.582   0.793  -2.111  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.905  -0.580   1.027  1.00  0.00           H  
CONECT    1   10   10    6    2                                       
CONECT    2    1    3   24   25                                       
CONECT    3    2    4   26   27                                       
CONECT    4    3    5   28   29                                       
CONECT    5    4    6   11                                            
CONECT    6    1    5    7    7                                       
CONECT    7    6    6    8   30                                       
CONECT    8    7    9    9   31                                       
CONECT    9    8    8   10   32                                       
CONECT   10    1    1    9   33                                       
CONECT   11    5   13   12   12                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   18                                            
CONECT   14   13   15   34   35                                       
CONECT   15   14   16   36   37                                       
CONECT   16   15   17   19   38                                       
CONECT   17   16   18   39   40                                       
CONECT   18   13   17   41   42                                       
CONECT   19   16   20   23   23                                       
CONECT   20   19   21   45                                            
CONECT   21   20   22   22   43                                       
CONECT   22   21   21   23                                            
CONECT   23   19   19   22   44                                       
CONECT   24    2                                                      
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   21                                                      
CONECT   44   23                                                      
CONECT   45   20                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
