COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.582   1.342   0.184  1.00  0.00           C  
HETATM    2  N   UNL     1       3.037  -0.234   0.147  1.00  0.00           N  
HETATM    3  C   UNL     1       2.362  -1.400   0.174  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.166  -0.207  -0.345  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.659   2.320  -0.293  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.553   1.020   1.838  1.00  0.00           C  
HETATM    7  C   UNL     1       0.660  -3.591  -1.124  1.00  0.00           C  
HETATM    8  C   UNL     1       0.488  -3.432   1.364  1.00  0.00           C  
HETATM    9  C   UNL     1       0.210  -2.711   0.043  1.00  0.00           C  
HETATM   10  C   UNL     1       0.969  -1.409   0.013  1.00  0.00           C  
HETATM   11  C   UNL     1       0.299  -0.218  -0.173  1.00  0.00           C  
HETATM   12  C   UNL     1       2.375   0.938  -0.046  1.00  0.00           C  
HETATM   13  C   UNL     1       3.326   1.955  -0.023  1.00  0.00           C  
HETATM   14  C   UNL     1       3.078   3.357  -0.180  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.063   0.601   0.324  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.544   0.919   0.312  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.726   0.065  -0.150  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.912  -1.016  -1.229  1.00  0.00           C  
HETATM   19  N   UNL     1       1.009   0.956  -0.197  1.00  0.00           N  
HETATM   20  N   UNL     1       2.882   4.469  -0.305  1.00  0.00           N  
HETATM   21  N   UNL     1       4.402   0.054   0.280  1.00  0.00           N  
HETATM   22  N   UNL     1      -3.292   0.299  -0.129  1.00  0.00           N  
HETATM   23  N   UNL     1      -3.174  -0.712  -1.090  1.00  0.00           N  
HETATM   24  O   UNL     1       2.963  -2.448   0.339  1.00  0.00           O  
HETATM   25  H   UNL     1       5.531   1.854   0.249  1.00  0.00           H  
HETATM   26  H   UNL     1      -3.817   2.928   0.036  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.653   2.248  -1.380  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.591   2.781   0.035  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.484   1.482   2.166  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.470   0.022   2.269  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.710   1.629   2.167  1.00  0.00           H  
HETATM   32  H   UNL     1       0.111  -4.533  -1.102  1.00  0.00           H  
HETATM   33  H   UNL     1       0.463  -3.077  -2.064  1.00  0.00           H  
HETATM   34  H   UNL     1       1.728  -3.792  -1.037  1.00  0.00           H  
HETATM   35  H   UNL     1       0.167  -2.805   2.195  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.062  -4.374   1.386  1.00  0.00           H  
HETATM   37  H   UNL     1       1.556  -3.633   1.451  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.858  -2.510  -0.043  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.821   1.339   1.075  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.720  -0.007  -1.237  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.644  -0.933   0.281  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.658   0.527   0.178  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.510  -1.758  -1.904  1.00  0.00           H  
HETATM   44  H   UNL     1       0.548   1.799  -0.334  1.00  0.00           H  
CONECT    1   13   21   21   25                                       
CONECT    2   12   21    3                                            
CONECT    3    2   10   24   24                                       
CONECT    4   15   15   18   11                                       
CONECT    5   16   26   27   28                                       
CONECT    6   16   29   30   31                                       
CONECT    7    9   32   33   34                                       
CONECT    8    9   35   36   37                                       
CONECT    9   10    8    7   38                                       
CONECT   10   11   11    3    9                                       
CONECT   11   19    4   10   10                                       
CONECT   12   13   13   19    2                                       
CONECT   13   14   12   12    1                                       
CONECT   14   20   20   20   13                                       
CONECT   15   22    4    4   39                                       
CONECT   16   17    5    6   22                                       
CONECT   17   16   40   41   42                                       
CONECT   18   23   23    4   43                                       
CONECT   19   12   11   44                                            
CONECT   20   14   14   14                                            
CONECT   21    1    1    2                                            
CONECT   22   16   15   23                                            
CONECT   23   22   18   18                                            
CONECT   24    3    3                                                 
CONECT   25    1                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   15                                                      
CONECT   40   17                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
