COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.426   0.440  -0.203  1.00  0.00           N  
HETATM    2  C   UNL     1       4.684  -0.286  -0.014  1.00  0.00           C  
HETATM    3  C   UNL     1       5.680   0.128  -1.099  1.00  0.00           C  
HETATM    4  C   UNL     1       6.756  -2.127  -1.119  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.482  -1.053  -0.621  1.00  0.00           C  
HETATM    6  C   UNL     1       0.845   1.635   0.752  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.556   3.209   0.458  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.750   2.162   0.938  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.464   2.167   1.464  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.321   1.126   1.681  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.757  -1.656  -1.111  1.00  0.00           C  
HETATM   12  B   UNL     1       5.277   0.054   1.399  1.00  0.00           B  
HETATM   13  C   UNL     1       0.956   0.535  -0.306  1.00  0.00           C  
HETATM   14  C   UNL     1       8.030  -0.127  -1.908  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.347  -0.118  -0.762  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.388   2.461   0.490  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.446   3.612  -0.200  1.00  0.00           C  
HETATM   18  C   UNL     1       2.250  -0.213  -0.117  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.921   3.199   0.730  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.663   1.136   1.937  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.702  -0.774  -1.242  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.608  -2.812  -0.368  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.403  -3.092   0.255  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.338  -2.222   0.128  1.00  0.00           C  
HETATM   25  C   UNL     1       6.994  -0.631  -0.901  1.00  0.00           C  
HETATM   26  N   UNL     1      -1.733   4.076  -0.225  1.00  0.00           N  
HETATM   27  N   UNL     1      -0.169  -0.392  -0.166  1.00  0.00           N  
HETATM   28  O   UNL     1       6.064  -0.906   2.089  1.00  0.00           O  
HETATM   29  O   UNL     1       5.028   1.322   1.988  1.00  0.00           O  
HETATM   30  O   UNL     1      -1.475   0.900  -1.415  1.00  0.00           O  
HETATM   31  O   UNL     1       2.234  -1.405   0.111  1.00  0.00           O  
HETATM   32 CL   UNL     1      -3.892   0.677  -2.176  1.00  0.00          Cl  
HETATM   33 CL   UNL     1      -3.226  -4.546   1.187  1.00  0.00          Cl  
HETATM   34  H   UNL     1       3.439   1.393  -0.385  1.00  0.00           H  
HETATM   35  H   UNL     1       4.498  -1.358  -0.081  1.00  0.00           H  
HETATM   36  H   UNL     1       5.268  -0.108  -2.080  1.00  0.00           H  
HETATM   37  H   UNL     1       5.866   1.200  -1.031  1.00  0.00           H  
HETATM   38  H   UNL     1       7.692  -2.667  -0.979  1.00  0.00           H  
HETATM   39  H   UNL     1       6.018  -2.486  -0.402  1.00  0.00           H  
HETATM   40  H   UNL     1       6.390  -2.292  -2.132  1.00  0.00           H  
HETATM   41  H   UNL     1       0.775   1.182   1.741  1.00  0.00           H  
HETATM   42  H   UNL     1       1.727   2.274   0.706  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.523   2.161   1.676  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.705   0.320   2.050  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.700  -1.444  -1.594  1.00  0.00           H  
HETATM   46  H   UNL     1       0.937   0.983  -1.299  1.00  0.00           H  
HETATM   47  H   UNL     1       8.199   0.939  -1.752  1.00  0.00           H  
HETATM   48  H   UNL     1       8.966  -0.668  -1.767  1.00  0.00           H  
HETATM   49  H   UNL     1       7.663  -0.293  -2.921  1.00  0.00           H  
HETATM   50  H   UNL     1       0.399   4.101  -0.662  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.552   3.997   0.368  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.105   0.335   2.511  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.435  -3.500  -0.271  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.396  -2.446   0.607  1.00  0.00           H  
HETATM   55  H   UNL     1       7.360  -0.465   0.112  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.023   4.891  -0.663  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.067  -1.204   0.355  1.00  0.00           H  
HETATM   58  H   UNL     1       6.179  -1.738   1.609  1.00  0.00           H  
HETATM   59  H   UNL     1       4.483   1.908   1.444  1.00  0.00           H  
CONECT    1    2   18   34                                            
CONECT    2    3   12    1   35                                       
CONECT    3   25    2   36   37                                       
CONECT    4   25   38   39   40                                       
CONECT    5   21   15   24   24                                       
CONECT    6   16   13   41   42                                       
CONECT    7   26    8    8   19                                       
CONECT    8   16    7    7   10                                       
CONECT    9   19   19   20   43                                       
CONECT   10    8   20   20   44                                       
CONECT   11   21   21   22   45                                       
CONECT   12   29    2   28                                            
CONECT   13    6   18   27   46                                       
CONECT   14   25   47   48   49                                       
CONECT   15   30   30   27    5                                       
CONECT   16    6   17   17    8                                       
CONECT   17   16   16   26   50                                       
CONECT   18    1   13   31   31                                       
CONECT   19    7    9    9   51                                       
CONECT   20   10   10    9   52                                       
CONECT   21   32   11   11    5                                       
CONECT   22   11   23   23   53                                       
CONECT   23   22   22   24   33                                       
CONECT   24    5    5   23   54                                       
CONECT   25   14    3    4   55                                       
CONECT   26   17    7   56                                            
CONECT   27   13   15   57                                            
CONECT   28   12   58                                                 
CONECT   29   12   59                                                 
CONECT   30   15   15                                                 
CONECT   31   18   18                                                 
CONECT   32   21                                                      
CONECT   33   23                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   17                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   22                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
