COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.265  -0.208  -0.201  1.00  0.00           C  
HETATM    2  C   UNL     1       6.319  -1.313  -0.677  1.00  0.00           C  
HETATM    3  O   UNL     1       5.356  -0.761  -1.577  1.00  0.00           O  
HETATM    4  C   UNL     1       4.376   0.005  -1.028  1.00  0.00           C  
HETATM    5  C   UNL     1       3.844   1.077  -1.725  1.00  0.00           C  
HETATM    6  C   UNL     1       2.847   1.845  -1.151  1.00  0.00           C  
HETATM    7  C   UNL     1       2.381   1.548   0.116  1.00  0.00           C  
HETATM    8  C   UNL     1       1.294   2.391   0.734  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.018   1.830   0.385  1.00  0.00           N  
HETATM   10  C   UNL     1      -1.104   2.740   0.786  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.402   2.269   0.125  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.582   0.795   0.356  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.600   0.012   0.743  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.207   0.511   1.001  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.918   0.201   0.138  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.474   0.178  -1.142  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.719  -0.382  -1.340  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.417  -0.920  -0.272  1.00  0.00           C  
HETATM   19 CL   UNL     1      -7.984  -1.623  -0.529  1.00  0.00          Cl  
HETATM   20  C   UNL     1      -5.870  -0.901   1.000  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.626  -0.343   1.210  1.00  0.00           C  
HETATM   22  C   UNL     1       2.907   0.479   0.818  1.00  0.00           C  
HETATM   23  C   UNL     1       3.905  -0.294   0.249  1.00  0.00           C  
HETATM   24  N   UNL     1       4.452  -1.383   0.943  1.00  0.00           N  
HETATM   25  C   UNL     1       5.615  -1.917   0.512  1.00  0.00           C  
HETATM   26  O   UNL     1       6.091  -2.878   1.078  1.00  0.00           O  
HETATM   27  H   UNL     1       8.001  -0.630   0.483  1.00  0.00           H  
HETATM   28  H   UNL     1       7.774   0.228  -1.060  1.00  0.00           H  
HETATM   29  H   UNL     1       6.692   0.564   0.313  1.00  0.00           H  
HETATM   30  H   UNL     1       6.893  -2.086  -1.189  1.00  0.00           H  
HETATM   31  H   UNL     1       4.206   1.312  -2.715  1.00  0.00           H  
HETATM   32  H   UNL     1       2.432   2.681  -1.695  1.00  0.00           H  
HETATM   33  H   UNL     1       1.411   2.396   1.817  1.00  0.00           H  
HETATM   34  H   UNL     1       1.366   3.410   0.355  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.217   2.720   1.870  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.871   3.754   0.460  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.245   2.809   0.556  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.355   2.466  -0.946  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.804  -1.040   0.883  1.00  0.00           H  
HETATM   40  H   UNL     1       0.512  -0.191   0.578  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.044   0.587   2.076  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.931   0.599  -1.975  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.151  -0.400  -2.330  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.419  -1.322   1.829  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.198  -0.333   2.202  1.00  0.00           H  
HETATM   46  H   UNL     1       2.542   0.249   1.808  1.00  0.00           H  
HETATM   47  H   UNL     1       4.002  -1.747   1.722  1.00  0.00           H  
CONECT    1    2   27   28   29                                       
CONECT    2    3    1   25   30                                       
CONECT    3    4    2                                                 
CONECT    4    5    3   23   23                                       
CONECT    5    6    6    4   31                                       
CONECT    6    5    5    7   32                                       
CONECT    7    6    8   22   22                                       
CONECT    8    9    7   33   34                                       
CONECT    9   10   14    8                                            
CONECT   10   11    9   35   36                                       
CONECT   11   12   10   37   38                                       
CONECT   12   15   11   13   13                                       
CONECT   13   12   12   14   39                                       
CONECT   14   13    9   40   41                                       
CONECT   15   16   16   21   12                                       
CONECT   16   17   15   15   42                                       
CONECT   17   18   18   16   43                                       
CONECT   18   19   17   17   20                                       
CONECT   19   18                                                      
CONECT   20   18   21   21   44                                       
CONECT   21   20   20   15   45                                       
CONECT   22    7    7   23   46                                       
CONECT   23    4    4   22   24                                       
CONECT   24   23   25   47                                            
CONECT   25    2   24   26   26                                       
CONECT   26   25   25                                                 
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   24                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
