COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.368   0.670   0.292  1.00  0.00           C  
HETATM    2  C   UNL     1       5.207   1.709   1.213  1.00  0.00           C  
HETATM    3  C   UNL     1       3.980   2.342   1.283  1.00  0.00           C  
HETATM    4  N   UNL     1       3.001   1.949   0.482  1.00  0.00           N  
HETATM    5  N   UNL     1       4.342   0.328  -0.480  1.00  0.00           N  
HETATM    6  C   UNL     1       3.183   0.961  -0.382  1.00  0.00           C  
HETATM    7  C   UNL     1       0.869   1.153  -1.033  1.00  0.00           C  
HETATM    8  C   UNL     1       0.074   1.424  -2.139  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.176   1.985  -1.968  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.636   2.279  -0.697  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.847   2.011   0.406  1.00  0.00           C  
HETATM   12  C   UNL     1       0.404   1.449   0.242  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.000   2.893  -0.515  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.320   2.151  -0.186  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.489   1.404  -0.016  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.300   2.621   0.090  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.062   3.411  -0.089  1.00  0.00           C  
HETATM   18  C   UNL     1      -8.147  -0.394   0.229  1.00  0.00           C  
HETATM   19  C   UNL     1      -8.182  -1.923   0.243  1.00  0.00           C  
HETATM   20  C   UNL     1      -9.835  -3.697   0.488  1.00  0.00           C  
HETATM   21  C   UNL     1     -11.253  -4.165   0.691  1.00  0.00           C  
HETATM   22  C   UNL     1     -11.288  -5.694   0.705  1.00  0.00           C  
HETATM   23  C   UNL     1       6.771  -0.939  -0.818  1.00  0.00           C  
HETATM   24  C   UNL     1       7.608  -2.043  -0.595  1.00  0.00           C  
HETATM   25  C   UNL     1       7.784  -2.991  -1.606  1.00  0.00           C  
HETATM   26  C   UNL     1       7.136  -2.836  -2.813  1.00  0.00           C  
HETATM   27  C   UNL     1       6.311  -1.745  -3.030  1.00  0.00           C  
HETATM   28  C   UNL     1       6.127  -0.800  -2.041  1.00  0.00           C  
HETATM   29  C   UNL     1       8.298  -2.202   0.699  1.00  0.00           C  
HETATM   30  C   UNL     1       9.815  -3.402   2.180  1.00  0.00           C  
HETATM   31  N   UNL     1       2.133   0.579  -1.202  1.00  0.00           N  
HETATM   32  N   UNL     1      -3.997   1.830  -0.366  1.00  0.00           N  
HETATM   33  N   UNL     1      -6.768   0.061   0.032  1.00  0.00           N  
HETATM   34  N   UNL     1      -9.560  -2.378   0.441  1.00  0.00           N  
HETATM   35  N   UNL     1       6.583   0.009   0.182  1.00  0.00           N  
HETATM   36  N   UNL     1       9.130  -3.244   0.895  1.00  0.00           N  
HETATM   37  O   UNL     1      -5.782   4.595  -0.136  1.00  0.00           O  
HETATM   38  O   UNL     1      -8.479   2.872   0.255  1.00  0.00           O  
HETATM   39  O   UNL     1      -8.940  -4.507   0.366  1.00  0.00           O  
HETATM   40  O   UNL     1       8.116  -1.393   1.588  1.00  0.00           O  
HETATM   41 CL   UNL     1       6.516   2.192   2.245  1.00  0.00          Cl  
HETATM   42  H   UNL     1       3.822   3.148   1.984  1.00  0.00           H  
HETATM   43  H   UNL     1       0.433   1.196  -3.132  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.795   2.196  -2.828  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.209   2.241   1.397  1.00  0.00           H  
HETATM   46  H   UNL     1       1.020   1.239   1.104  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.000   3.519   0.377  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.244   3.501  -1.386  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.771  -0.023  -0.584  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.522  -0.013   1.179  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.806  -2.304  -0.706  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.557  -2.293   1.056  1.00  0.00           H  
HETATM   53  H   UNL     1     -11.628  -3.784   1.640  1.00  0.00           H  
HETATM   54  H   UNL     1     -11.878  -3.794  -0.122  1.00  0.00           H  
HETATM   55  H   UNL     1     -10.912  -6.075  -0.245  1.00  0.00           H  
HETATM   56  H   UNL     1     -10.663  -6.064   1.518  1.00  0.00           H  
HETATM   57  H   UNL     1     -12.314  -6.033   0.852  1.00  0.00           H  
HETATM   58  H   UNL     1       8.426  -3.843  -1.442  1.00  0.00           H  
HETATM   59  H   UNL     1       7.274  -3.570  -3.594  1.00  0.00           H  
HETATM   60  H   UNL     1       5.809  -1.632  -3.979  1.00  0.00           H  
HETATM   61  H   UNL     1       5.482   0.048  -2.217  1.00  0.00           H  
HETATM   62  H   UNL     1      10.438  -2.528   2.370  1.00  0.00           H  
HETATM   63  H   UNL     1       9.077  -3.501   2.976  1.00  0.00           H  
HETATM   64  H   UNL     1      10.440  -4.294   2.151  1.00  0.00           H  
HETATM   65  H   UNL     1       2.275  -0.086  -1.893  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.723   0.900  -0.394  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.053  -0.587  -0.066  1.00  0.00           H  
HETATM   68  H   UNL     1     -10.276  -1.730   0.538  1.00  0.00           H  
HETATM   69  H   UNL     1       7.301   0.208   0.803  1.00  0.00           H  
HETATM   70  H   UNL     1       9.275  -3.889   0.186  1.00  0.00           H  
CONECT    1    2   35    5    5                                       
CONECT    2   41    3    3    1                                       
CONECT    3    2    2    4   42                                       
CONECT    4    3    6    6                                            
CONECT    5    1    1    6                                            
CONECT    6    4    4    5   31                                       
CONECT    7   31   12   12    8                                       
CONECT    8    7    9    9   43                                       
CONECT    9    8    8   10   44                                       
CONECT   10   11   11    9   13                                       
CONECT   11   12   10   10   45                                       
CONECT   12    7    7   11   46                                       
CONECT   13   10   32   47   48                                       
CONECT   14   17   32   15   15                                       
CONECT   15   14   14   16   33                                       
CONECT   16   17   38   38   15                                       
CONECT   17   37   37   14   16                                       
CONECT   18   33   19   49   50                                       
CONECT   19   18   34   51   52                                       
CONECT   20   34   21   39   39                                       
CONECT   21   22   20   53   54                                       
CONECT   22   21   55   56   57                                       
CONECT   23   24   35   28   28                                       
CONECT   24   29   25   25   23                                       
CONECT   25   24   24   26   58                                       
CONECT   26   25   27   27   59                                       
CONECT   27   26   26   28   60                                       
CONECT   28   23   23   27   61                                       
CONECT   29   36   40   40   24                                       
CONECT   30   36   62   63   64                                       
CONECT   31    6    7   65                                            
CONECT   32   13   14   66                                            
CONECT   33   15   18   67                                            
CONECT   34   19   20   68                                            
CONECT   35    1   23   69                                            
CONECT   36   30   29   70                                            
CONECT   37   17   17                                                 
CONECT   38   16   16                                                 
CONECT   39   20   20                                                 
CONECT   40   29   29                                                 
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   27                                                      
CONECT   61   28                                                      
CONECT   62   30                                                      
CONECT   63   30                                                      
CONECT   64   30                                                      
CONECT   65   31                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   34                                                      
CONECT   69   35                                                      
CONECT   70   36                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
