COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.015  -0.300  -1.758  1.00  0.00           C  
HETATM    2  N   UNL     1       5.631   1.056   0.525  1.00  0.00           N  
HETATM    3  C   UNL     1      -6.388  -0.105  -0.311  1.00  0.00           C  
HETATM    4  N   UNL     1       5.301  -1.097   0.398  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.400  -0.108   0.671  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.752   0.072   2.007  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.076   0.253   2.350  1.00  0.00           C  
HETATM    8  C   UNL     1      -8.053   0.255   1.372  1.00  0.00           C  
HETATM    9 CL   UNL     1      -4.174   2.060  -1.031  1.00  0.00          Cl  
HETATM   10  C   UNL     1      -3.324   0.648  -0.487  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.977  -0.303   0.296  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.709   0.082   0.043  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.922  -1.796  -2.064  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.999   0.461  -0.833  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.321  -0.664  -0.400  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.964  -1.607   0.381  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.290  -1.437   0.724  1.00  0.00           C  
HETATM   18  C   UNL     1       0.123  -0.862  -0.780  1.00  0.00           C  
HETATM   19  N   UNL     1       0.987  -0.250   0.239  1.00  0.00           N  
HETATM   20  C   UNL     1       2.405  -0.424  -0.100  1.00  0.00           C  
HETATM   21  C   UNL     1       3.271   0.225   0.982  1.00  0.00           C  
HETATM   22  C   UNL     1       4.727   0.046   0.635  1.00  0.00           C  
HETATM   23  C   UNL     1       6.616  -0.898   0.124  1.00  0.00           C  
HETATM   24  C   UNL     1       6.845   0.486   0.196  1.00  0.00           C  
HETATM   25  C   UNL     1       7.674  -1.754  -0.194  1.00  0.00           C  
HETATM   26  C   UNL     1       8.920  -1.241  -0.423  1.00  0.00           C  
HETATM   27  C   UNL     1       9.144   0.128  -0.362  1.00  0.00           C  
HETATM   28  C   UNL     1       8.115   0.991  -0.049  1.00  0.00           C  
HETATM   29  C   UNL     1       8.368   2.474   0.026  1.00  0.00           C  
HETATM   30  H   UNL     1      -6.775   0.154  -2.394  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.051   0.171  -1.952  1.00  0.00           H  
HETATM   32  H   UNL     1       5.455   2.002   0.650  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.990   0.071   2.772  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.351   0.388   3.386  1.00  0.00           H  
HETATM   35  H   UNL     1      -9.089   0.396   1.645  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.476   0.084  -0.718  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.162  -2.250  -1.429  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.886  -2.267  -1.871  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.652  -1.937  -3.111  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.492   1.194  -1.442  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.430  -2.484   0.716  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.790  -2.174   1.334  1.00  0.00           H  
HETATM   43  H   UNL     1       0.339  -1.929  -0.845  1.00  0.00           H  
HETATM   44  H   UNL     1       0.313  -0.394  -1.746  1.00  0.00           H  
HETATM   45  H   UNL     1       0.762   0.726   0.364  1.00  0.00           H  
HETATM   46  H   UNL     1       2.636  -1.488  -0.160  1.00  0.00           H  
HETATM   47  H   UNL     1       2.610   0.047  -1.061  1.00  0.00           H  
HETATM   48  H   UNL     1       3.040   1.289   1.043  1.00  0.00           H  
HETATM   49  H   UNL     1       3.066  -0.246   1.943  1.00  0.00           H  
HETATM   50  H   UNL     1       7.508  -2.819  -0.259  1.00  0.00           H  
HETATM   51  H   UNL     1       9.735  -1.905  -0.669  1.00  0.00           H  
HETATM   52  H   UNL     1      10.134   0.518  -0.545  1.00  0.00           H  
HETATM   53  H   UNL     1       8.657   2.743   1.042  1.00  0.00           H  
HETATM   54  H   UNL     1       9.170   2.741  -0.663  1.00  0.00           H  
HETATM   55  H   UNL     1       7.460   3.012  -0.248  1.00  0.00           H  
CONECT    1    3   13   30   31                                       
CONECT    2   22   24   32                                            
CONECT    3   12   12    5    1                                       
CONECT    4   22   22   23                                            
CONECT    5    6    6    3   11                                       
CONECT    6    7    5    5   33                                       
CONECT    7    8    8    6   34                                       
CONECT    8    7    7   12   35                                       
CONECT    9   10                                                      
CONECT   10   11   11   14    9                                       
CONECT   11   17    5   10   10                                       
CONECT   12    8    3    3   36                                       
CONECT   13    1   37   38   39                                       
CONECT   14   15   15   10   40                                       
CONECT   15   16   18   14   14                                       
CONECT   16   17   17   15   41                                       
CONECT   17   16   16   11   42                                       
CONECT   18   15   19   43   44                                       
CONECT   19   18   20   45                                            
CONECT   20   19   21   46   47                                       
CONECT   21   20   22   48   49                                       
CONECT   22   21    4    4    2                                       
CONECT   23    4   24   24   25                                       
CONECT   24    2   23   23   28                                       
CONECT   25   23   26   26   50                                       
CONECT   26   25   25   27   51                                       
CONECT   27   28   28   26   52                                       
CONECT   28   24   29   27   27                                       
CONECT   29   28   53   54   55                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
