COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.861  -1.768   1.458  1.00  0.00           O  
HETATM    2  C   UNL     1      -6.370  -2.045   0.384  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.441  -3.458  -0.136  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.179  -4.337   0.877  1.00  0.00           C  
HETATM    5  N   UNL     1      -5.765  -1.088  -0.348  1.00  0.00           N  
HETATM    6  C   UNL     1      -5.811   0.248   0.071  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.782   0.661   0.970  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.826   1.980   1.383  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.904   2.891   0.900  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.932   2.487   0.004  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.929   3.483  -0.519  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.877   1.165  -0.410  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.890   0.753  -1.314  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.568   0.682  -0.909  1.00  0.00           C  
HETATM   15  N   UNL     1      -2.250   1.103   0.313  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.011   1.061   0.756  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.011   0.555  -0.097  1.00  0.00           C  
HETATM   18  C   UNL     1       1.330   0.476   0.301  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.675   0.194  -1.749  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.387   0.115  -1.392  1.00  0.00           C  
HETATM   21  C   UNL     1       0.589  -0.399  -2.260  1.00  0.00           C  
HETATM   22  C   UNL     1       1.886  -0.462  -1.860  1.00  0.00           C  
HETATM   23  C   UNL     1       2.269  -0.031  -0.580  1.00  0.00           C  
HETATM   24  C   UNL     1       3.691  -0.117  -0.169  1.00  0.00           C  
HETATM   25  C   UNL     1       4.416   1.045   0.092  1.00  0.00           C  
HETATM   26 CL   UNL     1       3.653   2.597  -0.063  1.00  0.00          Cl  
HETATM   27  C   UNL     1       4.306  -1.362  -0.037  1.00  0.00           C  
HETATM   28 CL   UNL     1       3.408  -2.813  -0.354  1.00  0.00          Cl  
HETATM   29  C   UNL     1       5.636  -1.439   0.347  1.00  0.00           C  
HETATM   30  O   UNL     1       6.236  -2.651   0.475  1.00  0.00           O  
HETATM   31  C   UNL     1       7.608  -2.657   0.875  1.00  0.00           C  
HETATM   32  C   UNL     1       6.354  -0.280   0.600  1.00  0.00           C  
HETATM   33  C   UNL     1       5.745   0.960   0.476  1.00  0.00           C  
HETATM   34  O   UNL     1       6.452   2.093   0.730  1.00  0.00           O  
HETATM   35  C   UNL     1       7.817   1.932   1.121  1.00  0.00           C  
HETATM   36  H   UNL     1      -6.976  -3.470  -1.085  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.432  -3.842  -0.283  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.231  -5.359   0.501  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.644  -4.325   1.826  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.188  -3.952   1.024  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.298  -1.324  -1.164  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.505  -0.047   1.349  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.584   2.301   2.083  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.943   3.920   1.225  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.059   3.502   0.138  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.619   3.194  -1.523  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.383   4.474  -0.549  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.133   0.517  -2.223  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.767   1.406   1.749  1.00  0.00           H  
HETATM   50  H   UNL     1       1.628   0.809   1.284  1.00  0.00           H  
HETATM   51  H   UNL     1       0.310  -0.744  -3.245  1.00  0.00           H  
HETATM   52  H   UNL     1       2.632  -0.859  -2.533  1.00  0.00           H  
HETATM   53  H   UNL     1       7.964  -3.685   0.939  1.00  0.00           H  
HETATM   54  H   UNL     1       8.203  -2.112   0.141  1.00  0.00           H  
HETATM   55  H   UNL     1       7.705  -2.178   1.849  1.00  0.00           H  
HETATM   56  H   UNL     1       7.390  -0.343   0.900  1.00  0.00           H  
HETATM   57  H   UNL     1       8.363   1.417   0.331  1.00  0.00           H  
HETATM   58  H   UNL     1       8.263   2.911   1.293  1.00  0.00           H  
HETATM   59  H   UNL     1       7.865   1.344   2.038  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    5                                       
CONECT    3    2    4   36   37                                       
CONECT    4    3   38   39   40                                       
CONECT    5    2    6   41                                            
CONECT    6    5    7    7   12                                       
CONECT    7    6    6    8   42                                       
CONECT    8    7    9    9   43                                       
CONECT    9    8    8   10   44                                       
CONECT   10   12   12    9   11                                       
CONECT   11   10   45   46   47                                       
CONECT   12    6   13   10   10                                       
CONECT   13   12   14   48                                            
CONECT   14   13   15   15   19                                       
CONECT   15   14   14   16                                            
CONECT   16   15   17   17   49                                       
CONECT   17   16   16   20   18                                       
CONECT   18   17   23   23   50                                       
CONECT   19   14   20   20                                            
CONECT   20   19   19   17   21                                       
CONECT   21   20   22   22   51                                       
CONECT   22   21   21   23   52                                       
CONECT   23   18   18   22   24                                       
CONECT   24   23   27   27   25                                       
CONECT   25   24   26   33   33                                       
CONECT   26   25                                                      
CONECT   27   28   24   24   29                                       
CONECT   28   27                                                      
CONECT   29   27   30   32   32                                       
CONECT   30   29   31                                                 
CONECT   31   30   53   54   55                                       
CONECT   32   29   29   33   56                                       
CONECT   33   25   25   32   34                                       
CONECT   34   33   35                                                 
CONECT   35   34   57   58   59                                       
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   13                                                      
CONECT   49   16                                                      
CONECT   50   18                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   31                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
CONECT   57   35                                                      
CONECT   58   35                                                      
CONECT   59   35                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
