COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.272  -4.083  -0.622  1.00  0.00           C  
HETATM    2  C   UNL     1       2.165  -3.122   0.565  1.00  0.00           C  
HETATM    3  N   UNL     1       2.416  -1.749   0.105  1.00  0.00           N  
HETATM    4  C   UNL     1       3.752  -1.634  -0.496  1.00  0.00           C  
HETATM    5  C   UNL     1       3.859  -2.595  -1.683  1.00  0.00           C  
HETATM    6  N   UNL     1       3.608  -3.968  -1.223  1.00  0.00           N  
HETATM    7  C   UNL     1       2.247  -0.787   1.202  1.00  0.00           C  
HETATM    8  C   UNL     1       2.269   0.614   0.649  1.00  0.00           C  
HETATM    9  C   UNL     1       1.085   1.220   0.246  1.00  0.00           C  
HETATM   10  C   UNL     1       1.132   2.527  -0.266  1.00  0.00           C  
HETATM   11  C   UNL     1       2.347   3.204  -0.367  1.00  0.00           C  
HETATM   12  C   UNL     1       3.502   2.594   0.034  1.00  0.00           C  
HETATM   13  C   UNL     1       3.468   1.301   0.547  1.00  0.00           C  
HETATM   14  O   UNL     1       4.620   0.706   0.948  1.00  0.00           O  
HETATM   15  C   UNL     1       5.823   1.466   0.817  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.191   0.777   0.247  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.046   1.707  -0.239  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.257   2.891  -0.601  1.00  0.00           C  
HETATM   19  O   UNL     1      -0.660   3.941  -1.072  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.393   1.569  -0.369  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.044   0.321   0.037  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.448  -0.741   0.541  1.00  0.00           N  
HETATM   23  N   UNL     1      -3.395  -1.735   0.806  1.00  0.00           N  
HETATM   24  C   UNL     1      -4.642  -1.282   0.454  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.482   0.026  -0.037  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.596   0.747  -0.468  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.837   0.180  -0.408  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.002  -1.110   0.079  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.917  -1.843   0.502  1.00  0.00           C  
HETATM   30  H   UNL     1       2.115  -5.105  -0.278  1.00  0.00           H  
HETATM   31  H   UNL     1       1.516  -3.829  -1.365  1.00  0.00           H  
HETATM   32  H   UNL     1       1.165  -3.185   0.994  1.00  0.00           H  
HETATM   33  H   UNL     1       2.903  -3.393   1.320  1.00  0.00           H  
HETATM   34  H   UNL     1       3.909  -0.612  -0.840  1.00  0.00           H  
HETATM   35  H   UNL     1       4.508  -1.888   0.247  1.00  0.00           H  
HETATM   36  H   UNL     1       3.121  -2.323  -2.438  1.00  0.00           H  
HETATM   37  H   UNL     1       4.859  -2.532  -2.112  1.00  0.00           H  
HETATM   38  H   UNL     1       4.323  -4.269  -0.577  1.00  0.00           H  
HETATM   39  H   UNL     1       1.295  -0.967   1.700  1.00  0.00           H  
HETATM   40  H   UNL     1       3.060  -0.908   1.918  1.00  0.00           H  
HETATM   41  H   UNL     1       2.375   4.209  -0.762  1.00  0.00           H  
HETATM   42  H   UNL     1       4.443   3.118  -0.045  1.00  0.00           H  
HETATM   43  H   UNL     1       6.667   0.875   1.172  1.00  0.00           H  
HETATM   44  H   UNL     1       5.976   1.726  -0.230  1.00  0.00           H  
HETATM   45  H   UNL     1       5.743   2.377   1.410  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.982   2.379  -0.772  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.202  -2.609   1.180  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.477   1.751  -0.848  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.698   0.740  -0.743  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.990  -1.544   0.121  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.054  -2.845   0.881  1.00  0.00           H  
CONECT    1    2    6   30   31                                       
CONECT    2    1    3   32   33                                       
CONECT    3    2    4    7                                            
CONECT    4    3    5   34   35                                       
CONECT    5    4    6   36   37                                       
CONECT    6    1    5   38                                            
CONECT    7    3    8   39   40                                       
CONECT    8    7    9    9   13                                       
CONECT    9    8    8   10   16                                       
CONECT   10    9   11   11   18                                       
CONECT   11   10   10   12   41                                       
CONECT   12   11   13   13   42                                       
CONECT   13    8   12   12   14                                       
CONECT   14   13   15                                                 
CONECT   15   14   43   44   45                                       
CONECT   16    9   17                                                 
CONECT   17   16   18   20   20                                       
CONECT   18   10   17   19   19                                       
CONECT   19   18   18                                                 
CONECT   20   17   17   21   46                                       
CONECT   21   20   22   22   25                                       
CONECT   22   21   21   23                                            
CONECT   23   22   24   47                                            
CONECT   24   23   25   25   29                                       
CONECT   25   21   24   24   26                                       
CONECT   26   25   27   27   48                                       
CONECT   27   26   26   28   49                                       
CONECT   28   27   29   29   50                                       
CONECT   29   24   28   28   51                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   20                                                      
CONECT   47   23                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
