COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.090   0.910   0.186  1.00  0.00           C  
HETATM    2  C   UNL     1       4.336   1.363  -0.221  1.00  0.00           C  
HETATM    3  C   UNL     1       5.327   0.450  -0.535  1.00  0.00           C  
HETATM    4  C   UNL     1       5.032  -0.906  -0.428  1.00  0.00           C  
HETATM    5  C   UNL     1       3.746  -1.293  -0.009  1.00  0.00           C  
HETATM    6  C   UNL     1       3.752  -2.757   0.001  1.00  0.00           C  
HETATM    7  N   UNL     1       5.754  -2.056  -0.653  1.00  0.00           N  
HETATM    8  C   UNL     1      -0.406   2.085   0.066  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.288   4.188  -0.269  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.039   0.257  -0.340  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.540  -1.879   0.051  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.790  -3.154   0.336  1.00  0.00           C  
HETATM   13  C   UNL     1       2.165   2.356   1.976  1.00  0.00           C  
HETATM   14  C   UNL     1       2.013   1.911   0.520  1.00  0.00           C  
HETATM   15  N   UNL     1       2.828  -0.375   0.281  1.00  0.00           N  
HETATM   16  C   UNL     1       4.976  -3.149  -0.392  1.00  0.00           C  
HETATM   17  N   UNL     1       0.698   1.293   0.332  1.00  0.00           N  
HETATM   18  N   UNL     1      -0.255   3.398  -0.016  1.00  0.00           N  
HETATM   19  C   UNL     1      -2.537   3.630  -0.450  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.665   2.241  -0.364  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.586   1.509  -0.107  1.00  0.00           N  
HETATM   22  N   UNL     1      -3.900   1.637  -0.538  1.00  0.00           N  
HETATM   23  C   UNL     1      -2.997  -0.647  -0.078  1.00  0.00           C  
HETATM   24  N   UNL     1      -4.875  -1.763  -0.112  1.00  0.00           N  
HETATM   25  N   UNL     1      -5.166  -0.415  -0.359  1.00  0.00           N  
HETATM   26  C   UNL     1      -3.494  -4.214   1.185  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.305  -4.439  -0.316  1.00  0.00           C  
HETATM   28  H   UNL     1       4.531   2.422  -0.294  1.00  0.00           H  
HETATM   29  H   UNL     1       6.304   0.782  -0.854  1.00  0.00           H  
HETATM   30  H   UNL     1       2.929  -3.401   0.274  1.00  0.00           H  
HETATM   31  H   UNL     1       6.676  -2.087  -0.952  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.154   5.258  -0.333  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.712  -3.048   0.456  1.00  0.00           H  
HETATM   34  H   UNL     1       3.143   2.815   2.115  1.00  0.00           H  
HETATM   35  H   UNL     1       1.386   3.079   2.217  1.00  0.00           H  
HETATM   36  H   UNL     1       2.072   1.490   2.632  1.00  0.00           H  
HETATM   37  H   UNL     1       2.106   2.776  -0.136  1.00  0.00           H  
HETATM   38  H   UNL     1       5.297  -4.176  -0.488  1.00  0.00           H  
HETATM   39  H   UNL     1       0.601   0.330   0.394  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.396   4.252  -0.657  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.668   2.169  -0.798  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.949  -0.403   0.005  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.520  -2.486  -0.066  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.880  -4.806   1.864  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.501  -3.989   1.538  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.187  -4.361  -0.952  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.566  -5.178  -0.625  1.00  0.00           H  
CONECT    1   14    2   15   15                                       
CONECT    2    3    3    1   28                                       
CONECT    3    2    2    4   29                                       
CONECT    4    3    5    5    7                                       
CONECT    5   15    4    4    6                                       
CONECT    6    5   16   16   30                                       
CONECT    7    4   16   31                                            
CONECT    8   18   18   21   17                                       
CONECT    9   19   19   18   32                                       
CONECT   10   25   25   22   23                                       
CONECT   11   24   23   23   12                                       
CONECT   12   11   27   26   33                                       
CONECT   13   14   34   35   36                                       
CONECT   14   17    1   13   37                                       
CONECT   15    1    1    5                                            
CONECT   16    7    6    6   38                                       
CONECT   17    8   14   39                                            
CONECT   18    9    8    8                                            
CONECT   19    9    9   20   40                                       
CONECT   20   19   22   21   21                                       
CONECT   21   20   20    8                                            
CONECT   22   20   10   41                                            
CONECT   23   10   11   11   42                                       
CONECT   24   25   11   43                                            
CONECT   25   10   10   24                                            
CONECT   26   12   27   44   45                                       
CONECT   27   12   26   46   47                                       
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    9                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   19                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   26                                                      
CONECT   45   26                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
