COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.429   0.500   0.010  1.00  0.00           N  
HETATM    2  C   UNL     1       0.868  -1.186   0.093  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.082  -0.136   0.041  1.00  0.00           C  
HETATM    4  C   UNL     1       2.238  -0.878   0.078  1.00  0.00           C  
HETATM    5  N   UNL     1       0.427  -2.452   0.150  1.00  0.00           N  
HETATM    6  C   UNL     1       0.350   1.194  -0.025  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.456  -0.477   0.058  1.00  0.00           C  
HETATM    8  C   UNL     1       2.635   0.443   0.013  1.00  0.00           C  
HETATM    9  O   UNL     1       3.165  -1.872   0.128  1.00  0.00           O  
HETATM   10  C   UNL     1      -0.859  -2.709   0.157  1.00  0.00           C  
HETATM   11  C   UNL     1       1.688   1.473  -0.039  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.783  -1.761   0.121  1.00  0.00           N  
HETATM   13  O   UNL     1       3.961   0.746  -0.002  1.00  0.00           O  
HETATM   14  C   UNL     1       3.606  -2.283   1.424  1.00  0.00           C  
HETATM   15  O   UNL     1       2.104   2.766  -0.102  1.00  0.00           O  
HETATM   16  C   UNL     1       4.594   0.828  -1.280  1.00  0.00           C  
HETATM   17  C   UNL     1       1.091   3.772  -0.153  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.845   0.125   0.028  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.672   1.284   0.588  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.307  -0.190  -1.396  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.296   1.518   2.053  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.568  -1.427  -1.910  1.00  0.00           C  
HETATM   23  H   UNL     1      -2.175   1.436  -0.032  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.371   1.997  -0.065  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.179  -3.739   0.204  1.00  0.00           H  
HETATM   26  H   UNL     1       4.343  -3.079   1.321  1.00  0.00           H  
HETATM   27  H   UNL     1       4.057  -1.435   1.940  1.00  0.00           H  
HETATM   28  H   UNL     1       2.755  -2.647   1.999  1.00  0.00           H  
HETATM   29  H   UNL     1       5.647   1.077  -1.149  1.00  0.00           H  
HETATM   30  H   UNL     1       4.507  -0.131  -1.791  1.00  0.00           H  
HETATM   31  H   UNL     1       4.109   1.602  -1.876  1.00  0.00           H  
HETATM   32  H   UNL     1       1.558   4.755  -0.202  1.00  0.00           H  
HETATM   33  H   UNL     1       0.472   3.619  -1.037  1.00  0.00           H  
HETATM   34  H   UNL     1       0.470   3.707   0.740  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.980  -0.754   0.657  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.469   2.187   0.012  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.732   1.041   0.519  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.380  -0.382  -1.395  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.090   0.659  -2.045  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.885   2.344   2.451  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.499   0.616   2.628  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.236   1.762   2.121  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.897  -1.652  -2.924  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.495  -1.235  -1.911  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.784  -2.276  -1.261  1.00  0.00           H  
CONECT    1    7   18   23                                            
CONECT    2    4    5    5    3                                       
CONECT    3    2    6    7    7                                       
CONECT    4    9    8    8    2                                       
CONECT    5    2    2   10                                            
CONECT    6   11   11    3   24                                       
CONECT    7    3    3   12    1                                       
CONECT    8   13    4    4   11                                       
CONECT    9   14    4                                                 
CONECT   10    5   12   12   25                                       
CONECT   11    8   15    6    6                                       
CONECT   12   10   10    7                                            
CONECT   13   16    8                                                 
CONECT   14    9   26   27   28                                       
CONECT   15   11   17                                                 
CONECT   16   13   29   30   31                                       
CONECT   17   15   32   33   34                                       
CONECT   18    1   19   20   35                                       
CONECT   19   21   18   36   37                                       
CONECT   20   18   22   38   39                                       
CONECT   21   19   40   41   42                                       
CONECT   22   20   43   44   45                                       
CONECT   23    1                                                      
CONECT   24    6                                                      
CONECT   25   10                                                      
CONECT   26   14                                                      
CONECT   27   14                                                      
CONECT   28   14                                                      
CONECT   29   16                                                      
CONECT   30   16                                                      
CONECT   31   16                                                      
CONECT   32   17                                                      
CONECT   33   17                                                      
CONECT   34   17                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
