COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -6.399  -0.298  -0.402  1.00  0.00           N  
HETATM    2  C   UNL     1      -7.018  -0.344   0.930  1.00  0.00           C  
HETATM    3  N   UNL     1       1.239   0.084   0.251  1.00  0.00           N  
HETATM    4  C   UNL     1      -4.205  -0.822   0.460  1.00  0.00           C  
HETATM    5  N   UNL     1       3.481  -0.582   0.547  1.00  0.00           N  
HETATM    6  C   UNL     1      -2.856  -0.542   0.551  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.326   0.547  -0.127  1.00  0.00           C  
HETATM    8 CL   UNL     1       2.869  -3.517   0.352  1.00  0.00          Cl  
HETATM    9  C   UNL     1       1.726  -2.215   0.236  1.00  0.00           C  
HETATM   10  C   UNL     1       2.143  -0.886   0.345  1.00  0.00           C  
HETATM   11  C   UNL     1       3.902   0.752   0.555  1.00  0.00           C  
HETATM   12  C   UNL     1       5.152   1.094   0.039  1.00  0.00           C  
HETATM   13  N   UNL     1       5.989   0.104  -0.489  1.00  0.00           N  
HETATM   14  C   UNL     1       7.323   0.296  -0.524  1.00  0.00           C  
HETATM   15  O   UNL     1       7.809   1.282  -0.004  1.00  0.00           O  
HETATM   16  C   UNL     1       8.190  -0.687  -1.191  1.00  0.00           C  
HETATM   17  C   UNL     1       9.506  -0.497  -1.225  1.00  0.00           C  
HETATM   18  C   UNL     1       5.564   2.419   0.051  1.00  0.00           C  
HETATM   19  C   UNL     1       4.736   3.395   0.572  1.00  0.00           C  
HETATM   20  C   UNL     1       3.497   3.056   1.084  1.00  0.00           C  
HETATM   21  C   UNL     1       3.076   1.740   1.072  1.00  0.00           C  
HETATM   22  C   UNL     1       0.383  -2.470   0.036  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.464  -1.454  -0.048  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.040  -0.203   0.058  1.00  0.00           C  
HETATM   25  N   UNL     1      -0.957   0.831  -0.035  1.00  0.00           N  
HETATM   26  C   UNL     1      -3.152   1.355  -0.897  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.501   1.075  -0.989  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.032  -0.014  -0.310  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.491  -0.734   0.792  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.082   0.677  -1.263  1.00  0.00           C  
HETATM   31  C   UNL     1      -8.556   0.287  -1.401  1.00  0.00           C  
HETATM   32  N   UNL     1      -9.175   0.241  -0.069  1.00  0.00           N  
HETATM   33  C   UNL     1      -9.189   1.572   0.552  1.00  0.00           C  
HETATM   34  H   UNL     1      -6.503  -1.082   1.545  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.943   0.636   1.401  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.617  -1.672   0.984  1.00  0.00           H  
HETATM   37  H   UNL     1       4.125  -1.295   0.683  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.214  -1.171   1.150  1.00  0.00           H  
HETATM   39  H   UNL     1       5.609  -0.721  -0.830  1.00  0.00           H  
HETATM   40  H   UNL     1       7.759  -1.562  -1.653  1.00  0.00           H  
HETATM   41  H   UNL     1       9.938   0.379  -0.763  1.00  0.00           H  
HETATM   42  H   UNL     1      10.143  -1.219  -1.715  1.00  0.00           H  
HETATM   43  H   UNL     1       6.531   2.687  -0.348  1.00  0.00           H  
HETATM   44  H   UNL     1       5.058   4.426   0.581  1.00  0.00           H  
HETATM   45  H   UNL     1       2.854   3.823   1.491  1.00  0.00           H  
HETATM   46  H   UNL     1       2.108   1.478   1.472  1.00  0.00           H  
HETATM   47  H   UNL     1       0.027  -3.486  -0.052  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.652   1.752  -0.037  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.740   2.202  -1.425  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.144   1.703  -1.587  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.565  -1.727   0.347  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.960  -0.741   1.777  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.009   1.670  -0.818  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.614   0.684  -2.247  1.00  0.00           H  
HETATM   55  H   UNL     1      -9.071   1.026  -2.016  1.00  0.00           H  
HETATM   56  H   UNL     1      -8.630  -0.693  -1.871  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.165   1.908   0.716  1.00  0.00           H  
HETATM   58  H   UNL     1      -9.700   2.275  -0.106  1.00  0.00           H  
HETATM   59  H   UNL     1      -9.712   1.523   1.507  1.00  0.00           H  
CONECT    1    2   30   28                                            
CONECT    2   29    1   34   35                                       
CONECT    3   24   24   10                                            
CONECT    4   28   28    6   36                                       
CONECT    5   11   10   37                                            
CONECT    6    4    7    7   38                                       
CONECT    7    6    6   26   25                                       
CONECT    8    9                                                      
CONECT    9   10   10   22    8                                       
CONECT   10    3    5    9    9                                       
CONECT   11   12   12   21    5                                       
CONECT   12   18   11   11   13                                       
CONECT   13   12   14   39                                            
CONECT   14   13   16   15   15                                       
CONECT   15   14   14                                                 
CONECT   16   14   17   17   40                                       
CONECT   17   16   16   41   42                                       
CONECT   18   19   19   12   43                                       
CONECT   19   18   18   20   44                                       
CONECT   20   19   21   21   45                                       
CONECT   21   20   20   11   46                                       
CONECT   22   23   23    9   47                                       
CONECT   23   24   22   22                                            
CONECT   24   25    3    3   23                                       
CONECT   25    7   24   48                                            
CONECT   26   27   27    7   49                                       
CONECT   27   28   26   26   50                                       
CONECT   28    1    4    4   27                                       
CONECT   29   32    2   51   52                                       
CONECT   30   31    1   53   54                                       
CONECT   31   32   30   55   56                                       
CONECT   32   33   29   31                                            
CONECT   33   32   57   58   59                                       
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39   13                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
CONECT   57   33                                                      
CONECT   58   33                                                      
CONECT   59   33                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
