COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.783  -0.497   0.831  1.00  0.00           C  
HETATM    2  O   UNL     1       4.742  -1.018   1.928  1.00  0.00           O  
HETATM    3  O   UNL     1       5.971  -0.208   0.268  1.00  0.00           O  
HETATM    4  C   UNL     1       7.161  -0.547   1.027  1.00  0.00           C  
HETATM    5  C   UNL     1       8.387  -0.153   0.244  1.00  0.00           C  
HETATM    6  C   UNL     1       8.965  -1.052  -0.633  1.00  0.00           C  
HETATM    7  C   UNL     1      10.086  -0.689  -1.355  1.00  0.00           C  
HETATM    8  C   UNL     1      10.629   0.573  -1.201  1.00  0.00           C  
HETATM    9  C   UNL     1      10.051   1.472  -0.325  1.00  0.00           C  
HETATM   10  C   UNL     1       8.930   1.109   0.398  1.00  0.00           C  
HETATM   11  N   UNL     1       3.640  -0.213   0.176  1.00  0.00           N  
HETATM   12  C   UNL     1       2.347  -0.533   0.787  1.00  0.00           C  
HETATM   13  C   UNL     1       1.236  -0.118  -0.143  1.00  0.00           C  
HETATM   14  O   UNL     1       1.498   0.395  -1.210  1.00  0.00           O  
HETATM   15  N   UNL     1      -0.049  -0.316   0.212  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.129   0.087  -0.692  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.459  -0.242  -0.063  1.00  0.00           C  
HETATM   18  O   UNL     1      -2.500  -0.762   1.031  1.00  0.00           O  
HETATM   19  C   UNL     1      -5.255  -1.734  -0.410  1.00  0.00           C  
HETATM   20  O   UNL     1      -4.249  -2.595   0.126  1.00  0.00           O  
HETATM   21  C   UNL     1      -4.895  -0.278  -0.108  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.602   0.042  -0.718  1.00  0.00           N  
HETATM   23  C   UNL     1      -5.972   0.644  -0.682  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.682   2.067  -0.279  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.895   2.867  -1.086  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.208   2.574   0.894  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.629   4.172  -0.717  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.942   3.880   1.263  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.150   4.678   0.459  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.605  -2.068   0.228  1.00  0.00           C  
HETATM   31 CL   UNL     1      -7.100  -3.734  -0.250  1.00  0.00          Cl  
HETATM   32  H   UNL     1       7.150  -0.013   1.977  1.00  0.00           H  
HETATM   33  H   UNL     1       7.179  -1.621   1.214  1.00  0.00           H  
HETATM   34  H   UNL     1       8.541  -2.038  -0.753  1.00  0.00           H  
HETATM   35  H   UNL     1      10.538  -1.391  -2.040  1.00  0.00           H  
HETATM   36  H   UNL     1      11.506   0.857  -1.765  1.00  0.00           H  
HETATM   37  H   UNL     1      10.475   2.458  -0.204  1.00  0.00           H  
HETATM   38  H   UNL     1       8.475   1.813   1.079  1.00  0.00           H  
HETATM   39  H   UNL     1       3.673   0.203  -0.699  1.00  0.00           H  
HETATM   40  H   UNL     1       2.287  -1.606   0.969  1.00  0.00           H  
HETATM   41  H   UNL     1       2.250   0.002   1.732  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.258  -0.726   1.066  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.069   1.160  -0.874  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.031  -0.448  -1.636  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.365  -2.439  -0.234  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.832  -0.136   0.971  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.569   0.458  -1.594  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.974   0.567  -1.769  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.947   0.349  -0.295  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.487   2.472  -2.005  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.827   1.951   1.522  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.013   4.797  -1.347  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.354   4.276   2.180  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.942   5.698   0.748  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.318  -1.876  -1.489  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.518  -2.011   1.313  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.355  -1.354  -0.114  1.00  0.00           H  
CONECT    1   11    2    2    3                                       
CONECT    2    1    1                                                 
CONECT    3    1    4                                                 
CONECT    4    3    5   32   33                                       
CONECT    5    6   10   10    4                                       
CONECT    6    7    7    5   34                                       
CONECT    7    8    6    6   35                                       
CONECT    8    7    9    9   36                                       
CONECT    9   10    8    8   37                                       
CONECT   10    5    5    9   38                                       
CONECT   11   12    1   39                                            
CONECT   12   13   11   40   41                                       
CONECT   13   15   12   14   14                                       
CONECT   14   13   13                                                 
CONECT   15   16   13   42                                            
CONECT   16   15   17   43   44                                       
CONECT   17   16   18   18   22                                       
CONECT   18   17   17                                                 
CONECT   19   20   21   30   55                                       
CONECT   20   19   45                                                 
CONECT   21   19   22   23   46                                       
CONECT   22   17   21   47                                            
CONECT   23   21   24   48   49                                       
CONECT   24   23   25   25   26                                       
CONECT   25   24   24   27   50                                       
CONECT   26   24   28   28   51                                       
CONECT   27   25   29   29   52                                       
CONECT   28   26   26   29   53                                       
CONECT   29   27   27   28   54                                       
CONECT   30   19   56   57   31                                       
CONECT   31   30                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   19                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
