COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.270  -0.429   1.376  1.00  0.00           C  
HETATM    2  C   UNL     1       4.895  -0.362   1.257  1.00  0.00           C  
HETATM    3  C   UNL     1       4.324   0.339   0.191  1.00  0.00           C  
HETATM    4  C   UNL     1       2.854   0.415   0.056  1.00  0.00           C  
HETATM    5  C   UNL     1       2.100  -0.746  -0.431  1.00  0.00           C  
HETATM    6  C   UNL     1       2.617  -1.924  -0.891  1.00  0.00           C  
HETATM    7  C   UNL     1       0.388  -2.157  -1.041  1.00  0.00           C  
HETATM    8  C   UNL     1       0.634  -0.877  -0.516  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.434  -0.041  -0.204  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.724  -0.517  -0.429  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.892  -1.801  -0.952  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.905   0.328  -0.115  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.876   1.635   0.409  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.980   0.445   1.383  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.509   0.453   1.335  1.00  0.00           C  
HETATM   16  C   UNL     1      -8.492   0.323  -1.084  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.962   0.312  -1.109  1.00  0.00           C  
HETATM   18 CL   UNL     1       3.881  -1.148   2.426  1.00  0.00          Cl  
HETATM   19  C   UNL     1       5.148   0.967  -0.745  1.00  0.00           C  
HETATM   20  C   UNL     1       6.518   0.892  -0.613  1.00  0.00           C  
HETATM   21  C   UNL     1       7.408   1.570  -1.622  1.00  0.00           C  
HETATM   22  O   UNL     1       7.679   2.907  -1.196  1.00  0.00           O  
HETATM   23  C   UNL     1       7.079   0.196   0.445  1.00  0.00           C  
HETATM   24  O   UNL     1       2.268   1.441   0.350  1.00  0.00           O  
HETATM   25  N   UNL     1      -0.860  -2.565  -1.236  1.00  0.00           N  
HETATM   26  N   UNL     1       1.611  -2.756  -1.253  1.00  0.00           N  
HETATM   27  C   UNL     1      -4.213  -0.018  -0.287  1.00  0.00           C  
HETATM   28  N   UNL     1      -4.967   1.025   0.116  1.00  0.00           N  
HETATM   29  N   UNL     1      -4.109   2.044   0.547  1.00  0.00           N  
HETATM   30  C   UNL     1      -6.431   1.082   0.103  1.00  0.00           C  
HETATM   31  N   UNL     1      -8.968  -0.297   0.159  1.00  0.00           N  
HETATM   32  H   UNL     1       6.714  -0.966   2.201  1.00  0.00           H  
HETATM   33  H   UNL     1       3.670  -2.157  -0.957  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.268   0.947   0.200  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.890  -2.174  -1.128  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.989   2.201   0.654  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.640   1.015   2.247  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.623  -0.582   1.460  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.903  -0.013   2.239  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.866   1.481   1.272  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.848   1.352  -1.137  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.873  -0.237  -1.939  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.605  -0.718  -1.071  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.609   0.786  -2.025  1.00  0.00           H  
HETATM   45  H   UNL     1       4.712   1.510  -1.571  1.00  0.00           H  
HETATM   46  H   UNL     1       8.345   1.020  -1.708  1.00  0.00           H  
HETATM   47  H   UNL     1       6.909   1.592  -2.591  1.00  0.00           H  
HETATM   48  H   UNL     1       8.248   3.405  -1.800  1.00  0.00           H  
HETATM   49  H   UNL     1       8.153   0.145   0.545  1.00  0.00           H  
HETATM   50  H   UNL     1       1.734  -3.648  -1.611  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.578  -0.956  -0.677  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.755   2.121   0.045  1.00  0.00           H  
HETATM   53  H   UNL     1      -9.972  -0.387   0.156  1.00  0.00           H  
CONECT    1    2   23   23   32                                       
CONECT    2   18    3    3    1                                       
CONECT    3    4    2    2   19                                       
CONECT    4    5   24   24    3                                       
CONECT    5    8    6    6    4                                       
CONECT    6   26    5    5   33                                       
CONECT    7   25   26    8    8                                       
CONECT    8    7    7    9    5                                       
CONECT    9   10   10    8   34                                       
CONECT   10   11   12    9    9                                       
CONECT   11   25   25   10   35                                       
CONECT   12   13   10   27   27                                       
CONECT   13   29   29   12   36                                       
CONECT   14   30   15   37   38                                       
CONECT   15   14   31   39   40                                       
CONECT   16   17   31   41   42                                       
CONECT   17   30   16   43   44                                       
CONECT   18    2                                                      
CONECT   19    3   20   20   45                                       
CONECT   20   19   19   23   21                                       
CONECT   21   20   22   46   47                                       
CONECT   22   21   48                                                 
CONECT   23    1    1   20   49                                       
CONECT   24    4    4                                                 
CONECT   25   11   11    7                                            
CONECT   26    7    6   50                                            
CONECT   27   12   12   28   51                                       
CONECT   28   29   27   30                                            
CONECT   29   13   13   28                                            
CONECT   30   28   17   14   52                                       
CONECT   31   16   15   53                                            
CONECT   32    1                                                      
CONECT   33    6                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   19                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   23                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   30                                                      
CONECT   53   31                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
