COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.905  -0.855   0.657  1.00  0.00           C  
HETATM    2  C   UNL     1       8.257  -0.850   0.343  1.00  0.00           C  
HETATM    3  C   UNL     1       8.692  -1.413  -0.841  1.00  0.00           C  
HETATM    4  C   UNL     1       1.380   3.115  -1.266  1.00  0.00           C  
HETATM    5  C   UNL     1       1.970   4.373  -1.849  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.472   1.932  -0.545  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.777   0.383   0.250  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.232   0.401   0.570  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.451   1.268   1.811  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.453   2.349   1.837  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.326  -0.631   0.477  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.265  -1.775   1.252  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.268  -2.722   1.168  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.334  -2.526   0.309  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.396  -1.381  -0.465  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.394  -0.431  -0.376  1.00  0.00           C  
HETATM   17 CL   UNL     1      -8.734  -1.134  -1.544  1.00  0.00          Cl  
HETATM   18  N   UNL     1      -2.683   3.184   1.857  1.00  0.00           N  
HETATM   19  N   UNL     1      -2.934  -0.272   0.667  1.00  0.00           N  
HETATM   20  N   UNL     1      -1.730   1.616  -0.251  1.00  0.00           N  
HETATM   21  N   UNL     1      -0.562  -0.121   0.290  1.00  0.00           N  
HETATM   22  N   UNL     1       0.304   0.857  -0.216  1.00  0.00           N  
HETATM   23  N   UNL     1       0.082   3.035  -1.061  1.00  0.00           N  
HETATM   24  C   UNL     1       2.211   2.043  -0.952  1.00  0.00           C  
HETATM   25  C   UNL     1       1.652   0.897  -0.418  1.00  0.00           C  
HETATM   26  N   UNL     1       2.443  -0.184  -0.094  1.00  0.00           N  
HETATM   27  C   UNL     1       3.890  -0.125  -0.316  1.00  0.00           C  
HETATM   28  C   UNL     1       4.527  -1.445   0.124  1.00  0.00           C  
HETATM   29  N   UNL     1       3.872  -2.561  -0.572  1.00  0.00           N  
HETATM   30  C   UNL     1       5.995  -1.432  -0.217  1.00  0.00           C  
HETATM   31  O   UNL     1       6.475  -0.302   1.821  1.00  0.00           O  
HETATM   32  C   UNL     1       7.469   0.269   2.675  1.00  0.00           C  
HETATM   33  C   UNL     1       6.435  -1.994  -1.399  1.00  0.00           C  
HETATM   34  C   UNL     1       7.782  -1.982  -1.712  1.00  0.00           C  
HETATM   35  H   UNL     1       8.968  -0.405   1.024  1.00  0.00           H  
HETATM   36  H   UNL     1       9.744  -1.409  -1.086  1.00  0.00           H  
HETATM   37  H   UNL     1       1.174   5.096  -2.034  1.00  0.00           H  
HETATM   38  H   UNL     1       2.689   4.796  -1.148  1.00  0.00           H  
HETATM   39  H   UNL     1       2.471   4.138  -2.788  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.249   1.030  -0.321  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.452   1.698   1.781  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.346   0.655   2.706  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.432  -1.929   1.922  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.220  -3.615   1.773  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.118  -3.266   0.243  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.444   0.465  -0.978  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.880  -1.173   1.022  1.00  0.00           H  
HETATM   48  H   UNL     1       3.275   2.106  -1.123  1.00  0.00           H  
HETATM   49  H   UNL     1       2.042  -0.984   0.280  1.00  0.00           H  
HETATM   50  H   UNL     1       4.089   0.039  -1.375  1.00  0.00           H  
HETATM   51  H   UNL     1       4.313   0.694   0.265  1.00  0.00           H  
HETATM   52  H   UNL     1       4.405  -1.567   1.200  1.00  0.00           H  
HETATM   53  H   UNL     1       2.901  -2.630  -0.310  1.00  0.00           H  
HETATM   54  H   UNL     1       3.972  -2.471  -1.572  1.00  0.00           H  
HETATM   55  H   UNL     1       6.992   0.674   3.567  1.00  0.00           H  
HETATM   56  H   UNL     1       8.184  -0.501   2.964  1.00  0.00           H  
HETATM   57  H   UNL     1       7.988   1.067   2.145  1.00  0.00           H  
HETATM   58  H   UNL     1       5.727  -2.444  -2.079  1.00  0.00           H  
HETATM   59  H   UNL     1       8.124  -2.422  -2.637  1.00  0.00           H  
CONECT    1    2    2   30   31                                       
CONECT    2    3    1    1   35                                       
CONECT    3   34   34    2   36                                       
CONECT    4   24    5   23   23                                       
CONECT    5    4   37   38   39                                       
CONECT    6   22   23   20   20                                       
CONECT    7   21   21   19   20                                       
CONECT    8    9   11   19   40                                       
CONECT    9   10    8   41   42                                       
CONECT   10   18   18   18    9                                       
CONECT   11   12    8   16   16                                       
CONECT   12   13   13   11   43                                       
CONECT   13   12   12   14   44                                       
CONECT   14   13   15   15   45                                       
CONECT   15   14   14   16   17                                       
CONECT   16   11   11   15   46                                       
CONECT   17   15                                                      
CONECT   18   10   10   10                                            
CONECT   19    8    7   47                                            
CONECT   20    7    6    6                                            
CONECT   21   22    7    7                                            
CONECT   22   25   21    6                                            
CONECT   23    4    4    6                                            
CONECT   24   25   25    4   48                                       
CONECT   25   26   24   24   22                                       
CONECT   26   27   25   49                                            
CONECT   27   28   26   50   51                                       
CONECT   28   30   27   29   52                                       
CONECT   29   28   53   54                                            
CONECT   30   33   33    1   28                                       
CONECT   31    1   32                                                 
CONECT   32   31   55   56   57                                       
CONECT   33   34   30   30   58                                       
CONECT   34    3    3   33   59                                       
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   16                                                      
CONECT   47   19                                                      
CONECT   48   24                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   32                                                      
CONECT   56   32                                                      
CONECT   57   32                                                      
CONECT   58   33                                                      
CONECT   59   34                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
