COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1      -8.282  -2.553   0.157  1.00  0.00          Cl  
HETATM    2  C   UNL     1      -6.909  -1.508  -0.030  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.113  -1.610  -1.159  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.021  -0.781  -1.312  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.718   0.159  -0.329  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.522   0.258   0.804  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.616  -0.572   0.947  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.544   1.052  -0.490  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.512   1.969  -1.500  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.443   2.788  -1.654  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.392   2.717  -0.817  1.00  0.00           C  
HETATM   12  O   UNL     1      -0.439   3.464  -0.973  1.00  0.00           O  
HETATM   13  C   UNL     1      -1.387   1.787   0.238  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.213   1.712   1.179  1.00  0.00           C  
HETATM   15  N   UNL     1       0.816   0.839   0.608  1.00  0.00           N  
HETATM   16  C   UNL     1       2.006   0.614   1.304  1.00  0.00           C  
HETATM   17  C   UNL     1       2.214   1.217   2.539  1.00  0.00           C  
HETATM   18  C   UNL     1       3.390   0.998   3.232  1.00  0.00           C  
HETATM   19  C   UNL     1       4.365   0.177   2.702  1.00  0.00           C  
HETATM   20  C   UNL     1       4.166  -0.434   1.463  1.00  0.00           C  
HETATM   21  C   UNL     1       2.978  -0.216   0.766  1.00  0.00           C  
HETATM   22  C   UNL     1       5.210  -1.312   0.893  1.00  0.00           C  
HETATM   23  O   UNL     1       5.845  -2.052   1.620  1.00  0.00           O  
HETATM   24  N   UNL     1       5.457  -1.294  -0.431  1.00  0.00           N  
HETATM   25  C   UNL     1       6.394  -2.251  -1.041  1.00  0.00           C  
HETATM   26  C   UNL     1       7.391  -1.469  -1.904  1.00  0.00           C  
HETATM   27  O   UNL     1       6.671  -0.623  -2.805  1.00  0.00           O  
HETATM   28  C   UNL     1       5.872   0.372  -2.161  1.00  0.00           C  
HETATM   29  C   UNL     1       4.793  -0.320  -1.312  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.457   0.961   0.407  1.00  0.00           C  
HETATM   31  H   UNL     1      -6.348  -2.339  -1.920  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.400  -0.862  -2.193  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.292   0.985   1.569  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.241  -0.493   1.823  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.346   2.041  -2.183  1.00  0.00           H  
HETATM   36  H   UNL     1       0.199   2.710   1.327  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.541   1.308   2.137  1.00  0.00           H  
HETATM   38  H   UNL     1       0.671   0.418  -0.254  1.00  0.00           H  
HETATM   39  H   UNL     1       1.454   1.860   2.959  1.00  0.00           H  
HETATM   40  H   UNL     1       3.546   1.470   4.191  1.00  0.00           H  
HETATM   41  H   UNL     1       5.283   0.009   3.246  1.00  0.00           H  
HETATM   42  H   UNL     1       2.816  -0.689  -0.191  1.00  0.00           H  
HETATM   43  H   UNL     1       6.930  -2.789  -0.258  1.00  0.00           H  
HETATM   44  H   UNL     1       5.845  -2.957  -1.663  1.00  0.00           H  
HETATM   45  H   UNL     1       8.028  -0.859  -1.263  1.00  0.00           H  
HETATM   46  H   UNL     1       8.006  -2.166  -2.472  1.00  0.00           H  
HETATM   47  H   UNL     1       6.503   0.988  -1.521  1.00  0.00           H  
HETATM   48  H   UNL     1       5.395   0.999  -2.915  1.00  0.00           H  
HETATM   49  H   UNL     1       4.085  -0.835  -1.961  1.00  0.00           H  
HETATM   50  H   UNL     1       4.267   0.421  -0.710  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.470   0.241   1.211  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.435   3.434  -2.378  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    3    1    7    7                                       
CONECT    3    4    4    2   31                                       
CONECT    4    3    3    5   32                                       
CONECT    5    4    8    6    6                                       
CONECT    6    5    5    7   33                                       
CONECT    7    2    2    6   34                                       
CONECT    8   30    5    9    9                                       
CONECT    9    8    8   10   35                                       
CONECT   10   11    9   52                                            
CONECT   11   13   12   12   10                                       
CONECT   12   11   11                                                 
CONECT   13   14   30   30   11                                       
CONECT   14   15   13   36   37                                       
CONECT   15   14   16   38                                            
CONECT   16   15   21   21   17                                       
CONECT   17   16   18   18   39                                       
CONECT   18   17   17   19   40                                       
CONECT   19   20   20   18   41                                       
CONECT   20   21   22   19   19                                       
CONECT   21   16   16   20   42                                       
CONECT   22   23   23   20   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   25   29                                            
CONECT   25   24   26   43   44                                       
CONECT   26   25   27   45   46                                       
CONECT   27   26   28                                                 
CONECT   28   29   27   47   48                                       
CONECT   29   24   28   49   50                                       
CONECT   30   13   13    8   51                                       
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36   14                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   21                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   28                                                      
CONECT   48   28                                                      
CONECT   49   29                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
CONECT   52   10                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
