COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.482  -0.269   0.109  1.00  0.00           C  
HETATM    2  C   UNL     1       6.126   0.852   0.609  1.00  0.00           C  
HETATM    3  C   UNL     1       7.503   0.865   0.723  1.00  0.00           C  
HETATM    4  N   UNL     1      -4.312  -2.790   0.324  1.00  0.00           N  
HETATM    5  C   UNL     1       7.610  -1.361  -0.160  1.00  0.00           C  
HETATM    6  C   UNL     1       6.229  -1.383  -0.277  1.00  0.00           C  
HETATM    7  C   UNL     1       1.929   0.861  -0.110  1.00  0.00           C  
HETATM    8  C   UNL     1       1.237  -0.347   0.020  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.328  -0.383   0.059  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.842   0.845  -0.088  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.139  -0.352   0.031  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.018  -1.588   0.194  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.412   0.797  -0.052  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.173   2.091  -0.192  1.00  0.00           C  
HETATM   15  C   UNL     1       1.220   2.060  -0.229  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.155   2.048  -0.223  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.029   0.805  -0.064  1.00  0.00           C  
HETATM   18  N   UNL     1       4.086  -0.287  -0.002  1.00  0.00           N  
HETATM   19  C   UNL     1       3.404   0.870  -0.116  1.00  0.00           C  
HETATM   20  O   UNL     1       4.005   1.921  -0.225  1.00  0.00           O  
HETATM   21  C   UNL     1      -6.404  -1.592   0.199  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.101  -0.400   0.070  1.00  0.00           C  
HETATM   23  C   UNL     1       8.243  -0.237   0.339  1.00  0.00           C  
HETATM   24  N   UNL     1       5.585  -2.518  -0.782  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.233   0.836  -0.082  1.00  0.00           N  
HETATM   26  N   UNL     1      -2.925  -0.375   0.053  1.00  0.00           N  
HETATM   27  O   UNL     1      -8.461  -0.404   0.081  1.00  0.00           O  
HETATM   28  H   UNL     1       5.551   1.716   0.909  1.00  0.00           H  
HETATM   29  H   UNL     1       8.003   1.740   1.112  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.342  -2.786   0.320  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.793  -3.627   0.418  1.00  0.00           H  
HETATM   32  H   UNL     1       8.191  -2.221  -0.458  1.00  0.00           H  
HETATM   33  H   UNL     1       1.781  -1.275   0.112  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.675  -1.284   0.132  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.361   2.510   0.796  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.585   2.796  -0.780  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.122   1.902  -0.694  1.00  0.00           H  
HETATM   38  H   UNL     1       1.753   2.995  -0.326  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.703   2.974  -0.315  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.496   1.738  -0.168  1.00  0.00           H  
HETATM   41  H   UNL     1       3.609  -1.132   0.004  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.941  -2.524   0.303  1.00  0.00           H  
HETATM   43  H   UNL     1       9.320  -0.222   0.430  1.00  0.00           H  
HETATM   44  H   UNL     1       4.619  -2.532  -0.863  1.00  0.00           H  
HETATM   45  H   UNL     1       6.106  -3.292  -1.050  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.723   1.668  -0.172  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.434  -1.207   0.143  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.861  -0.491  -0.795  1.00  0.00           H  
CONECT    1   18    2    2    6                                       
CONECT    2    1    1    3   28                                       
CONECT    3    2   23   23   29                                       
CONECT    4   12   30   31                                            
CONECT    5    6    6   23   32                                       
CONECT    6    1   24    5    5                                       
CONECT    7    8   15   15   19                                       
CONECT    8   11   11    7   33                                       
CONECT    9   17   17   12   26                                       
CONECT   10   25   11   16   16                                       
CONECT   11    8    8   10   34                                       
CONECT   12   21   21    9    4                                       
CONECT   13   14   22   22   17                                       
CONECT   14   13   35   36   37                                       
CONECT   15    7    7   16   38                                       
CONECT   16   10   10   15   39                                       
CONECT   17   13    9    9   40                                       
CONECT   18   19    1   41                                            
CONECT   19   20   20    7   18                                       
CONECT   20   19   19                                                 
CONECT   21   22   12   12   42                                       
CONECT   22   27   13   13   21                                       
CONECT   23    3    3    5   43                                       
CONECT   24    6   44   45                                            
CONECT   25   26   10   46                                            
CONECT   26   25    9   47                                            
CONECT   27   22   48                                                 
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    8                                                      
CONECT   34   11                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   21                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
