COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.119   0.674  -1.808  1.00  0.00           C  
HETATM    2  C   UNL     1       3.193   0.013  -0.982  1.00  0.00           C  
HETATM    3  C   UNL     1       3.871   0.740  -0.022  1.00  0.00           C  
HETATM    4  C   UNL     1       4.855   0.137   0.737  1.00  0.00           C  
HETATM    5  C   UNL     1       5.163  -1.201   0.534  1.00  0.00           C  
HETATM    6  C   UNL     1       4.481  -1.929  -0.430  1.00  0.00           C  
HETATM    7  C   UNL     1       3.493  -1.322  -1.182  1.00  0.00           C  
HETATM    8  O   UNL     1       6.131  -1.797   1.278  1.00  0.00           O  
HETATM    9  C   UNL     1       6.395  -3.177   1.015  1.00  0.00           C  
HETATM   10  N   UNL     1       0.806   0.378  -1.230  1.00  0.00           N  
HETATM   11  C   UNL     1       0.103   1.181  -0.414  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.046   0.521  -0.123  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.991  -0.641  -0.765  1.00  0.00           N  
HETATM   14  N   UNL     1       0.119  -0.698  -1.420  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.132   1.067   0.766  1.00  0.00           C  
HETATM   16  C   UNL     1       0.454   2.546   0.115  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.916   2.578   0.920  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.461   2.852   1.307  1.00  0.00           C  
HETATM   19  O   UNL     1       1.819   2.562   0.538  1.00  0.00           O  
HETATM   20  C   UNL     1       0.242   3.593  -0.980  1.00  0.00           C  
HETATM   21  O   UNL     1      -3.429   0.816   0.164  1.00  0.00           O  
HETATM   22  C   UNL     1      -4.037  -0.343   0.481  1.00  0.00           C  
HETATM   23  O   UNL     1      -3.498  -1.123   1.240  1.00  0.00           O  
HETATM   24  N   UNL     1      -5.243  -0.636  -0.044  1.00  0.00           N  
HETATM   25  C   UNL     1      -5.904  -1.897   0.301  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.417  -1.744   0.128  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.396  -3.008  -0.621  1.00  0.00           C  
HETATM   28  H   UNL     1       2.279   1.753  -1.814  1.00  0.00           H  
HETATM   29  H   UNL     1       2.161   0.295  -2.829  1.00  0.00           H  
HETATM   30  H   UNL     1       3.631   1.782   0.136  1.00  0.00           H  
HETATM   31  H   UNL     1       5.385   0.706   1.486  1.00  0.00           H  
HETATM   32  H   UNL     1       4.718  -2.970  -0.590  1.00  0.00           H  
HETATM   33  H   UNL     1       2.959  -1.889  -1.930  1.00  0.00           H  
HETATM   34  H   UNL     1       6.708  -3.295  -0.022  1.00  0.00           H  
HETATM   35  H   UNL     1       7.187  -3.528   1.676  1.00  0.00           H  
HETATM   36  H   UNL     1       5.490  -3.759   1.190  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.082   0.586   1.743  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.140   3.075  -0.023  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.577   2.961   1.698  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.184   2.218   2.149  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.351   3.899   1.590  1.00  0.00           H  
HETATM   42  H   UNL     1       2.112   3.413   0.890  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.802   3.585  -1.293  1.00  0.00           H  
HETATM   44  H   UNL     1       0.497   4.580  -0.594  1.00  0.00           H  
HETATM   45  H   UNL     1       0.879   3.361  -1.834  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.673  -0.013  -0.650  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.681  -2.154   1.336  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.640  -1.488  -0.908  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.909  -2.682   0.384  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.779  -0.952   0.784  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.319  -3.118  -0.498  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.888  -3.947  -0.364  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.619  -2.752  -1.656  1.00  0.00           H  
CONECT    1    2   10   28   29                                       
CONECT    2    3    1    7    7                                       
CONECT    3    4    4    2   30                                       
CONECT    4    3    3    5   31                                       
CONECT    5    4    8    6    6                                       
CONECT    6    5    5    7   32                                       
CONECT    7    2    2    6   33                                       
CONECT    8    5    9                                                 
CONECT    9    8   34   35   36                                       
CONECT   10    1   14   11                                            
CONECT   11   10   12   12   16                                       
CONECT   12   13   11   11   15                                       
CONECT   13   14   14   12                                            
CONECT   14   10   13   13                                            
CONECT   15   12   21   17   37                                       
CONECT   16   11   19   20   18                                       
CONECT   17   15   18   38   39                                       
CONECT   18   16   17   40   41                                       
CONECT   19   16   42                                                 
CONECT   20   16   43   44   45                                       
CONECT   21   15   22                                                 
CONECT   22   21   24   23   23                                       
CONECT   23   22   22                                                 
CONECT   24   22   25   46                                            
CONECT   25   24   26   27   47                                       
CONECT   26   25   48   49   50                                       
CONECT   27   25   51   52   53                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   15                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
