COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.024  -0.951   0.013  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.502  -0.937   0.021  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.215  -2.137   0.033  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.192   0.277   0.022  1.00  0.00           C  
HETATM    5  C   UNL     1       1.846  -0.909  -0.002  1.00  0.00           C  
HETATM    6  C   UNL     1       3.186  -0.479  -0.018  1.00  0.00           C  
HETATM    7  C   UNL     1       4.382  -1.357  -0.020  1.00  0.00           C  
HETATM    8  C   UNL     1       5.659  -0.800  -0.037  1.00  0.00           C  
HETATM    9  C   UNL     1       6.767  -1.622  -0.038  1.00  0.00           C  
HETATM   10  C   UNL     1       6.613  -2.996  -0.024  1.00  0.00           C  
HETATM   11  C   UNL     1       5.347  -3.555  -0.007  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.339   0.210   0.001  1.00  0.00           N  
HETATM   13  C   UNL     1      -4.594  -2.116   0.040  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.271  -0.910   0.035  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.571   0.284   0.029  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.427  -2.010   0.022  1.00  0.00           O  
HETATM   17  C   UNL     1       1.054   0.196  -0.006  1.00  0.00           C  
HETATM   18  C   UNL     1       4.232  -2.742   0.000  1.00  0.00           C  
HETATM   19  C   UNL     1       1.453   2.625  -0.026  1.00  0.00           C  
HETATM   20  C   UNL     1       0.299   2.992  -0.707  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.111   4.310  -0.708  1.00  0.00           C  
HETATM   22  C   UNL     1       0.625   5.266  -0.031  1.00  0.00           C  
HETATM   23  C   UNL     1       1.774   4.904   0.648  1.00  0.00           C  
HETATM   24  C   UNL     1       2.190   3.587   0.653  1.00  0.00           C  
HETATM   25  N   UNL     1      -6.752  -0.895   0.042  1.00  0.00           N  
HETATM   26  N   UNL     1       3.195   0.838  -0.031  1.00  0.00           N  
HETATM   27  N   UNL     1       1.869   1.288  -0.018  1.00  0.00           N  
HETATM   28  O   UNL     1      -7.371  -1.944   0.052  1.00  0.00           O  
HETATM   29  O   UNL     1      -7.350   0.166   0.038  1.00  0.00           O  
HETATM   30  H   UNL     1      -2.688  -3.079   0.036  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.646   1.209   0.017  1.00  0.00           H  
HETATM   32  H   UNL     1       1.507  -1.934   0.007  1.00  0.00           H  
HETATM   33  H   UNL     1       5.781   0.273  -0.049  1.00  0.00           H  
HETATM   34  H   UNL     1       7.758  -1.191  -0.051  1.00  0.00           H  
HETATM   35  H   UNL     1       7.483  -3.636  -0.030  1.00  0.00           H  
HETATM   36  H   UNL     1       5.232  -4.628   0.004  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.816   1.054  -0.002  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.147  -3.044   0.049  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.106   1.222   0.030  1.00  0.00           H  
HETATM   40  H   UNL     1       3.244  -3.179   0.013  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.275   2.246  -1.236  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.008   4.596  -1.238  1.00  0.00           H  
HETATM   43  H   UNL     1       0.302   6.296  -0.034  1.00  0.00           H  
HETATM   44  H   UNL     1       2.347   5.653   1.175  1.00  0.00           H  
HETATM   45  H   UNL     1       3.087   3.306   1.184  1.00  0.00           H  
CONECT    1   12   16   16    2                                       
CONECT    2    1    3    3    4                                       
CONECT    3    2    2   13   30                                       
CONECT    4    2   15   15   31                                       
CONECT    5    6   17   17   32                                       
CONECT    6    7    5   26   26                                       
CONECT    7   18   18    8    6                                       
CONECT    8    9    9    7   33                                       
CONECT    9   10    8    8   34                                       
CONECT   10   11   11    9   35                                       
CONECT   11   10   10   18   36                                       
CONECT   12   17    1   37                                            
CONECT   13    3   14   14   38                                       
CONECT   14   13   13   15   25                                       
CONECT   15    4    4   14   39                                       
CONECT   16    1    1                                                 
CONECT   17    5    5   27   12                                       
CONECT   18   11    7    7   40                                       
CONECT   19   27   24   24   20                                       
CONECT   20   19   21   21   41                                       
CONECT   21   20   20   22   42                                       
CONECT   22   23   23   21   43                                       
CONECT   23   24   22   22   44                                       
CONECT   24   19   19   23   45                                       
CONECT   25   14   28   28   29                                       
CONECT   25   29                                                      
CONECT   26    6    6   27                                            
CONECT   27   26   17   19                                            
CONECT   28   25   25                                                 
CONECT   29   25   25                                                 
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   15                                                      
CONECT   40   18                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
