COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.947  -2.136  -0.091  1.00  0.00           C  
HETATM    2  N   UNL     1       4.963  -0.201   1.626  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.203  -0.350  -0.035  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.714  -0.087   0.015  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.717   2.132  -0.054  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.864  -1.482   0.082  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.112  -2.023   0.137  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.246  -1.214   0.128  1.00  0.00           C  
HETATM    9  C   UNL     1       6.270   0.887  -0.114  1.00  0.00           C  
HETATM   10  C   UNL     1       1.329   0.610  -0.165  1.00  0.00           C  
HETATM   11  C   UNL     1       2.567  -0.017  -0.167  1.00  0.00           C  
HETATM   12  C   UNL     1       2.638  -1.391  -0.101  1.00  0.00           C  
HETATM   13  C   UNL     1       1.469  -2.139  -0.040  1.00  0.00           C  
HETATM   14  C   UNL     1       0.237  -1.520  -0.041  1.00  0.00           C  
HETATM   15  C   UNL     1       0.164  -0.136  -0.103  1.00  0.00           C  
HETATM   16  C   UNL     1       3.793   0.854  -0.250  1.00  0.00           C  
HETATM   17  C   UNL     1       5.035   0.078   0.185  1.00  0.00           C  
HETATM   18  C   UNL     1       5.078  -1.241  -0.594  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.442   0.508  -0.043  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.867   0.737   0.012  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.469   2.673  -0.115  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.335   1.863  -0.106  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.139   0.142   0.064  1.00  0.00           C  
HETATM   24  O   UNL     1      -1.045   0.485  -0.101  1.00  0.00           O  
HETATM   25  O   UNL     1       6.870   0.714  -1.149  1.00  0.00           O  
HETATM   26  O   UNL     1       6.705   1.801   0.768  1.00  0.00           O  
HETATM   27  H   UNL     1       4.169  -2.458   0.926  1.00  0.00           H  
HETATM   28  H   UNL     1       3.868  -3.011  -0.735  1.00  0.00           H  
HETATM   29  H   UNL     1       4.924   0.655   2.159  1.00  0.00           H  
HETATM   30  H   UNL     1       4.177  -0.797   1.840  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.175  -0.938   0.882  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.218  -1.018  -0.896  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.587   2.773  -0.058  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.994  -2.122   0.088  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.225  -3.096   0.188  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.224  -1.669   0.172  1.00  0.00           H  
HETATM   37  H   UNL     1       1.274   1.687  -0.212  1.00  0.00           H  
HETATM   38  H   UNL     1       1.525  -3.217   0.008  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.667  -2.109   0.005  1.00  0.00           H  
HETATM   40  H   UNL     1       3.924   1.194  -1.277  1.00  0.00           H  
HETATM   41  H   UNL     1       3.664   1.719   0.400  1.00  0.00           H  
HETATM   42  H   UNL     1       6.036  -1.734  -0.430  1.00  0.00           H  
HETATM   43  H   UNL     1       4.944  -1.044  -1.658  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.357   3.746  -0.165  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.356   2.318  -0.150  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.027   0.757   0.058  1.00  0.00           H  
HETATM   47  H   UNL     1       7.502   2.295   0.532  1.00  0.00           H  
CONECT    1   12   18   27   28                                       
CONECT    2   17   29   30                                            
CONECT    3   19   24   31   32                                       
CONECT    4    6    6   19   20                                       
CONECT    5   20   21   21   33                                       
CONECT    6    4    4    7   34                                       
CONECT    7    6    8    8   35                                       
CONECT    8    7    7   23   36                                       
CONECT    9   17   25   25   26                                       
CONECT   10   11   11   15   37                                       
CONECT   11   10   10   12   16                                       
CONECT   12    1   11   13   13                                       
CONECT   13   12   12   14   38                                       
CONECT   14   13   15   15   39                                       
CONECT   15   10   14   14   24                                       
CONECT   16   17   40   41   11                                       
CONECT   17    2    9   16   18                                       
CONECT   18    1   17   42   43                                       
CONECT   19    3    4   22   22                                       
CONECT   20    4    5   23   23                                       
CONECT   21    5    5   22   44                                       
CONECT   22   19   19   21   45                                       
CONECT   23    8   20   20   46                                       
CONECT   24    3   15                                                 
CONECT   25    9    9                                                 
CONECT   26    9   47                                                 
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   10                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   26                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
