COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.579   2.056  -0.005  1.00  0.00           C  
HETATM    2  C   UNL     1       1.795   2.732   0.123  1.00  0.00           C  
HETATM    3  C   UNL     1       2.964   1.995   0.102  1.00  0.00           C  
HETATM    4  N   UNL     1       2.898   0.679  -0.038  1.00  0.00           N  
HETATM    5  N   UNL     1       0.587   0.733  -0.137  1.00  0.00           N  
HETATM    6  C   UNL     1       3.899  -1.637   0.651  1.00  0.00           C  
HETATM    7  C   UNL     1       5.069  -2.365   0.739  1.00  0.00           C  
HETATM    8  C   UNL     1       5.236  -3.504  -0.028  1.00  0.00           C  
HETATM    9  C   UNL     1       4.233  -3.917  -0.886  1.00  0.00           C  
HETATM   10  C   UNL     1       3.061  -3.193  -0.979  1.00  0.00           C  
HETATM   11  C   UNL     1       2.890  -2.049  -0.210  1.00  0.00           C  
HETATM   12  N   UNL     1       1.704  -1.314  -0.302  1.00  0.00           N  
HETATM   13  C   UNL     1       1.730   0.064  -0.157  1.00  0.00           C  
HETATM   14 CL   UNL     1       1.837   4.458   0.304  1.00  0.00          Cl  
HETATM   15  N   UNL     1      -0.619   2.754   0.011  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.830   2.066  -0.110  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.974   0.806   0.454  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.894   2.646  -0.790  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.092   1.967  -0.910  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.236   0.711  -0.355  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.177   0.127   0.331  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.326  -1.143   0.897  1.00  0.00           N  
HETATM   23  C   UNL     1      -4.104  -2.063   0.294  1.00  0.00           C  
HETATM   24  O   UNL     1      -4.602  -1.822  -0.789  1.00  0.00           O  
HETATM   25  C   UNL     1      -4.351  -3.358   0.945  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.119  -4.266   0.350  1.00  0.00           C  
HETATM   27  H   UNL     1       3.921   2.486   0.198  1.00  0.00           H  
HETATM   28  H   UNL     1       3.768  -0.751   1.254  1.00  0.00           H  
HETATM   29  H   UNL     1       5.855  -2.045   1.408  1.00  0.00           H  
HETATM   30  H   UNL     1       6.153  -4.071   0.042  1.00  0.00           H  
HETATM   31  H   UNL     1       4.367  -4.806  -1.484  1.00  0.00           H  
HETATM   32  H   UNL     1       2.278  -3.516  -1.649  1.00  0.00           H  
HETATM   33  H   UNL     1       0.863  -1.768  -0.467  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.617   3.719   0.107  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.150   0.355   0.986  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.785   3.628  -1.226  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.917   2.421  -1.439  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.173   0.183  -0.450  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.868  -1.362   1.724  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.908  -3.572   1.907  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.561  -4.053  -0.612  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.300  -5.218   0.828  1.00  0.00           H  
CONECT    1    5    5    2   15                                       
CONECT    2    3    3    1   14                                       
CONECT    3    4    2    2   27                                       
CONECT    4   13   13    3                                            
CONECT    5   13    1    1                                            
CONECT    6   11   11    7   28                                       
CONECT    7    6    8    8   29                                       
CONECT    8    7    7    9   30                                       
CONECT    9   10   10    8   31                                       
CONECT   10   11    9    9   32                                       
CONECT   11   12    6    6   10                                       
CONECT   12   11   13   33                                            
CONECT   13   12    4    4    5                                       
CONECT   14    2                                                      
CONECT   15    1   16   34                                            
CONECT   16   17   15   18   18                                       
CONECT   17   21   21   16   35                                       
CONECT   18   16   16   19   36                                       
CONECT   19   20   20   18   37                                       
CONECT   20   21   19   19   38                                       
CONECT   21   22   17   17   20                                       
CONECT   22   23   21   39                                            
CONECT   23   24   24   22   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   26   40                                       
CONECT   26   25   25   41   42                                       
CONECT   27    3                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   12                                                      
CONECT   34   15                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   22                                                      
CONECT   40   25                                                      
CONECT   41   26                                                      
CONECT   42   26                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
