COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.570   1.205   7.182  1.00  0.00           O  
HETATM    2  N   UNL     1       0.187   0.895   8.287  1.00  0.00           N  
HETATM    3  C   UNL     1       0.157  -0.397   8.438  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.259  -1.152   9.674  1.00  0.00           C  
HETATM    5  C   UNL     1       0.586  -0.953   7.211  1.00  0.00           C  
HETATM    6  C   UNL     1       0.841   0.126   6.434  1.00  0.00           C  
HETATM    7  C   UNL     1       1.332   0.117   5.009  1.00  0.00           C  
HETATM    8  C   UNL     1       0.134   0.098   4.057  1.00  0.00           C  
HETATM    9  C   UNL     1       0.632   0.088   2.611  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.565   0.069   1.659  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.067   0.059   0.212  1.00  0.00           C  
HETATM   12  O   UNL     1      -1.186   0.041  -0.676  1.00  0.00           O  
HETATM   13  C   UNL     1      -0.684   0.033  -1.938  1.00  0.00           C  
HETATM   14  C   UNL     1       0.690   0.043  -2.137  1.00  0.00           C  
HETATM   15  C   UNL     1       1.202   0.036  -3.416  1.00  0.00           C  
HETATM   16  C   UNL     1       0.339   0.017  -4.513  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.042   0.007  -4.309  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.548   0.010  -3.027  1.00  0.00           C  
HETATM   19 CL   UNL     1      -3.265  -0.003  -2.772  1.00  0.00          Cl  
HETATM   20  C   UNL     1       0.885   0.009  -5.886  1.00  0.00           C  
HETATM   21  N   UNL     1       0.138  -0.007  -6.946  1.00  0.00           N  
HETATM   22  C   UNL     1       1.013  -0.019  -8.135  1.00  0.00           C  
HETATM   23  C   UNL     1       2.383  -0.399  -7.522  1.00  0.00           C  
HETATM   24  O   UNL     1       2.208   0.025  -6.153  1.00  0.00           O  
HETATM   25  H   UNL     1       0.611  -1.322  10.307  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.999  -0.569  10.223  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.692  -2.110   9.386  1.00  0.00           H  
HETATM   28  H   UNL     1       0.689  -1.996   6.953  1.00  0.00           H  
HETATM   29  H   UNL     1       1.928   1.011   4.824  1.00  0.00           H  
HETATM   30  H   UNL     1       1.943  -0.768   4.841  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.462  -0.795   4.242  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.477   0.984   4.225  1.00  0.00           H  
HETATM   33  H   UNL     1       1.228   0.982   2.426  1.00  0.00           H  
HETATM   34  H   UNL     1       1.244  -0.797   2.443  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.161  -0.824   1.844  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.177   0.955   1.827  1.00  0.00           H  
HETATM   37  H   UNL     1       0.529   0.953   0.028  1.00  0.00           H  
HETATM   38  H   UNL     1       0.544  -0.826   0.045  1.00  0.00           H  
HETATM   39  H   UNL     1       1.358   0.058  -1.288  1.00  0.00           H  
HETATM   40  H   UNL     1       2.271   0.044  -3.570  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.713  -0.007  -5.156  1.00  0.00           H  
HETATM   42  H   UNL     1       0.685  -0.771  -8.852  1.00  0.00           H  
HETATM   43  H   UNL     1       1.054   0.966  -8.598  1.00  0.00           H  
HETATM   44  H   UNL     1       2.555  -1.474  -7.583  1.00  0.00           H  
HETATM   45  H   UNL     1       3.192   0.152  -8.000  1.00  0.00           H  
CONECT    1    2    6                                                 
CONECT    2    1    3    3                                            
CONECT    3    2    2    4    5                                       
CONECT    4    3   25   26   27                                       
CONECT    5    3    6    6   28                                       
CONECT    6    1    5    5    7                                       
CONECT    7    6    8   29   30                                       
CONECT    8    7    9   31   32                                       
CONECT    9    8   10   33   34                                       
CONECT   10    9   11   35   36                                       
CONECT   11   10   12   37   38                                       
CONECT   12   11   13                                                 
CONECT   13   12   14   14   18                                       
CONECT   14   13   13   15   39                                       
CONECT   15   14   16   16   40                                       
CONECT   16   15   15   17   20                                       
CONECT   17   16   18   18   41                                       
CONECT   18   13   17   17   19                                       
CONECT   19   18                                                      
CONECT   20   16   21   21   24                                       
CONECT   21   20   20   22                                            
CONECT   22   21   23   42   43                                       
CONECT   23   22   24   44   45                                       
CONECT   24   20   23                                                 
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   17                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
