COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.766   2.253  -0.316  1.00  0.00           C  
HETATM    2  C   UNL     1       2.658  -0.123  -0.623  1.00  0.00           C  
HETATM    3  C   UNL     1       5.848  -1.763   1.943  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.105  -0.555  -0.056  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.070   0.057   2.051  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.945  -2.248   1.415  1.00  0.00           C  
HETATM    7  C   UNL     1       1.402  -0.832  -0.926  1.00  0.00           C  
HETATM    8  C   UNL     1       1.418  -2.198  -1.221  1.00  0.00           C  
HETATM    9  C   UNL     1       0.241  -2.859  -1.504  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.965  -2.179  -1.500  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.000  -0.825  -1.209  1.00  0.00           C  
HETATM   12  C   UNL     1       0.182  -0.144  -0.914  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.497   1.301  -0.805  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.454  -0.162  -1.356  1.00  0.00           C  
HETATM   15  C   UNL     1       4.764  -0.030   0.458  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.472   0.419   0.857  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.301  -1.276   2.332  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.342  -1.887   0.224  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.032   0.108  -1.128  1.00  0.00           N  
HETATM   20  N   UNL     1      -0.164   1.175  -0.663  1.00  0.00           N  
HETATM   21  N   UNL     1       3.582  -0.698   0.173  1.00  0.00           N  
HETATM   22  N   UNL     1       5.110   1.163   0.029  1.00  0.00           N  
HETATM   23  N   UNL     1       6.267   1.487   0.484  1.00  0.00           N  
HETATM   24  N   UNL     1       6.737   0.543   1.224  1.00  0.00           N  
HETATM   25  N   UNL     1       5.775  -0.482   1.236  1.00  0.00           N  
HETATM   26  O   UNL     1      -2.123   2.333  -0.655  1.00  0.00           O  
HETATM   27  O   UNL     1       2.861   0.981  -1.090  1.00  0.00           O  
HETATM   28 CL   UNL     1      -4.181   2.093   0.504  1.00  0.00          Cl  
HETATM   29  H   UNL     1       1.181   2.682  -1.228  1.00  0.00           H  
HETATM   30  H   UNL     1       0.235   3.025   0.241  1.00  0.00           H  
HETATM   31  H   UNL     1       1.573   1.853   0.297  1.00  0.00           H  
HETATM   32  H   UNL     1       6.307  -2.510   1.296  1.00  0.00           H  
HETATM   33  H   UNL     1       6.448  -1.646   2.845  1.00  0.00           H  
HETATM   34  H   UNL     1       4.843  -2.086   2.214  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.356   0.817   2.763  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.126  -3.289   1.635  1.00  0.00           H  
HETATM   37  H   UNL     1       2.354  -2.737  -1.227  1.00  0.00           H  
HETATM   38  H   UNL     1       0.261  -3.914  -1.732  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.880  -2.706  -1.723  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.559  -0.974  -2.075  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.935   0.734  -1.748  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.772  -1.559   3.261  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.056  -2.647  -0.488  1.00  0.00           H  
HETATM   44  H   UNL     1       3.420  -1.579   0.546  1.00  0.00           H  
CONECT    1   20   29   30   31                                       
CONECT    2   27   27   21    7                                       
CONECT    3   25   32   33   34                                       
CONECT    4   18   18   16   14                                       
CONECT    5   17   16   16   35                                       
CONECT    6   17   17   18   36                                       
CONECT    7    8    2   12   12                                       
CONECT    8    9    9    7   37                                       
CONECT    9    8    8   10   38                                       
CONECT   10    9   11   11   39                                       
CONECT   11   10   10   12   19                                       
CONECT   12    7    7   11   20                                       
CONECT   13   20   19   26   26                                       
CONECT   14   19    4   40   41                                       
CONECT   15   22   22   25   21                                       
CONECT   16    5    5    4   28                                       
CONECT   17    6    6    5   42                                       
CONECT   18    6    4    4   43                                       
CONECT   19   11   13   14                                            
CONECT   20   12    1   13                                            
CONECT   21   15    2   44                                            
CONECT   22   23   15   15                                            
CONECT   23   22   24   24                                            
CONECT   24   23   23   25                                            
CONECT   25   24   15    3                                            
CONECT   26   13   13                                                 
CONECT   27    2    2                                                 
CONECT   28   16                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   21                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
