COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.380   0.986   1.248  1.00  0.00           C  
HETATM    2  C   UNL     1       4.538   0.717   2.525  1.00  0.00           C  
HETATM    3  C   UNL     1       0.000  -0.405   0.341  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.431  -1.658   0.449  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.621  -0.331   0.232  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.401  -3.134   0.742  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.929   0.355   0.093  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.978   1.730  -0.128  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.198   2.363  -0.257  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.370   1.635  -0.168  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.328   0.269   0.052  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.114  -0.374   0.177  1.00  0.00           C  
HETATM   13  C   UNL     1       4.084  -0.152  -2.299  1.00  0.00           C  
HETATM   14  C   UNL     1       2.741  -0.376  -2.285  1.00  0.00           C  
HETATM   15  C   UNL     1       2.027  -0.298  -1.083  1.00  0.00           C  
HETATM   16  N   UNL     1       2.632  -0.013   0.040  1.00  0.00           N  
HETATM   17  C   UNL     1       4.740   0.156  -1.093  1.00  0.00           C  
HETATM   18  N   UNL     1       4.010   0.224   0.067  1.00  0.00           N  
HETATM   19  C   UNL     1       4.880   0.535   1.069  1.00  0.00           C  
HETATM   20  C   UNL     1       6.108   0.650   0.512  1.00  0.00           C  
HETATM   21  N   UNL     1       6.006   0.418  -0.798  1.00  0.00           N  
HETATM   22  C   UNL     1       0.541  -0.548  -1.083  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.486  -0.655   0.340  1.00  0.00           C  
HETATM   24  N   UNL     1      -2.080  -1.856   0.516  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.406   0.252   0.166  1.00  0.00           N  
HETATM   26  H   UNL     1       7.855   0.066   1.590  1.00  0.00           H  
HETATM   27  H   UNL     1       8.057   1.518   0.580  1.00  0.00           H  
HETATM   28  H   UNL     1       7.147   1.616   2.106  1.00  0.00           H  
HETATM   29  H   UNL     1       4.624  -0.239   3.041  1.00  0.00           H  
HETATM   30  H   UNL     1       5.226   1.434   2.973  1.00  0.00           H  
HETATM   31  H   UNL     1       3.517   1.088   2.615  1.00  0.00           H  
HETATM   32  H   UNL     1       0.490  -1.130   0.990  1.00  0.00           H  
HETATM   33  H   UNL     1       0.199   0.602   0.706  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.199  -2.411   0.552  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.263  -3.288   1.812  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.006  -3.944   0.334  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.429  -3.122   0.249  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.063   2.300  -0.198  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.237   3.428  -0.428  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.323   2.134  -0.270  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.247  -0.294   0.121  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.081  -1.441   0.343  1.00  0.00           H  
HETATM   43  H   UNL     1       4.639  -0.215  -3.224  1.00  0.00           H  
HETATM   44  H   UNL     1       2.224  -0.613  -3.204  1.00  0.00           H  
HETATM   45  H   UNL     1       0.342  -1.556  -1.448  1.00  0.00           H  
HETATM   46  H   UNL     1       0.051   0.177  -1.733  1.00  0.00           H  
CONECT    1   20   26   27   28                                       
CONECT    2   19   29   30   31                                       
CONECT    3   22   23   32   33                                       
CONECT    4   24    5    5   34                                       
CONECT    5    4    4   25    7                                       
CONECT    6   24   35   36   37                                       
CONECT    7    5    8    8   12                                       
CONECT    8    7    7    9   38                                       
CONECT    9    8   10   10   39                                       
CONECT   10    9    9   11   40                                       
CONECT   11   10   12   12   41                                       
CONECT   12    7   11   11   42                                       
CONECT   13   14   14   17   43                                       
CONECT   14   13   13   15   44                                       
CONECT   15   14   16   16   22                                       
CONECT   16   15   15   18                                            
CONECT   17   13   18   21   21                                       
CONECT   18   16   17   19                                            
CONECT   19   18   20   20    2                                       
CONECT   20   19   19   21    1                                       
CONECT   21   17   17   20                                            
CONECT   22   15    3   45   46                                       
CONECT   23    3   24   25   25                                       
CONECT   24   23    4    6                                            
CONECT   25   23   23    5                                            
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
