COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.292  -2.790   2.914  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.154  -2.523   1.927  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.738  -2.235   0.542  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.601  -1.967  -0.445  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.789  -0.760   0.027  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.205  -1.048   1.411  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.342  -1.315   2.399  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.651  -0.492  -0.961  1.00  0.00           C  
HETATM    9  C   UNL     1       0.521   0.632  -0.294  1.00  0.00           C  
HETATM   10  C   UNL     1       3.140   1.214   0.252  1.00  0.00           C  
HETATM   11  C   UNL     1       2.188   2.206   0.450  1.00  0.00           C  
HETATM   12  C   UNL     1       0.847   1.920   0.173  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.300   1.865  -0.139  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.068   3.494  -2.244  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.030   4.902  -2.843  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.787   2.714   1.383  1.00  0.00           C  
HETATM   17  C   UNL     1       6.710   1.349   0.785  1.00  0.00           C  
HETATM   18  C   UNL     1       1.212  -1.673  -0.945  1.00  0.00           C  
HETATM   19  C   UNL     1       1.600  -2.800  -0.214  1.00  0.00           C  
HETATM   20  C   UNL     1       1.265  -4.050  -0.707  1.00  0.00           C  
HETATM   21  C   UNL     1       0.563  -4.142  -1.898  1.00  0.00           C  
HETATM   22  C   UNL     1       0.508  -1.851  -2.135  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.237  -0.150  -2.332  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.842   0.631  -0.481  1.00  0.00           N  
HETATM   25  C   UNL     1       1.540  -0.311  -0.460  1.00  0.00           C  
HETATM   26  N   UNL     1       2.796   0.006  -0.185  1.00  0.00           N  
HETATM   27  N   UNL     1      -0.309   2.619   0.245  1.00  0.00           N  
HETATM   28  C   UNL     1      -2.743   2.296  -0.193  1.00  0.00           C  
HETATM   29  O   UNL     1      -2.835   3.569  -0.836  1.00  0.00           O  
HETATM   30  C   UNL     1      -3.298   2.401   1.228  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.742   3.782   1.713  1.00  0.00           C  
HETATM   32  C   UNL     1       4.563   1.504   0.541  1.00  0.00           C  
HETATM   33  N   UNL     1       5.629   0.627   0.403  1.00  0.00           N  
HETATM   34  O   UNL     1       7.865   0.971   0.821  1.00  0.00           O  
HETATM   35  O   UNL     1       6.252   2.568   1.110  1.00  0.00           O  
HETATM   36  N   UNL     1       5.052   2.631   0.963  1.00  0.00           N  
HETATM   37 CL   UNL     1       1.719  -5.486   0.156  1.00  0.00          Cl  
HETATM   38  N   UNL     1       0.212  -3.060  -2.565  1.00  0.00           N  
HETATM   39  H   UNL     1      -5.870  -3.651   2.578  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.876  -2.996   3.901  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.940  -1.916   2.968  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.507  -3.398   1.873  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.317  -3.095   0.206  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.386  -1.360   0.596  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.953  -2.842  -0.499  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.017  -1.762  -1.432  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.436   0.116   0.081  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.557  -1.923   1.358  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.626  -0.187   1.748  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.990  -0.440   2.453  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.926  -1.521   3.385  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.026  -1.381  -1.044  1.00  0.00           H  
HETATM   53  H   UNL     1       2.479   3.183   0.806  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.045   3.048  -2.427  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.295   2.881  -2.708  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.207   4.844  -3.917  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.802   5.515  -2.379  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.052   5.348  -2.659  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.372   2.846   0.473  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.315   2.252   2.218  1.00  0.00           H  
HETATM   61  H   UNL     1       2.147  -2.699   0.712  1.00  0.00           H  
HETATM   62  H   UNL     1       0.300  -5.115  -2.286  1.00  0.00           H  
HETATM   63  H   UNL     1       0.202  -0.989  -2.709  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.426   0.027  -3.039  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.850  -0.979  -2.683  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.850   0.748  -2.252  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.320   1.562  -0.756  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.846   1.732   1.960  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.639   4.616   1.019  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.582   4.022   2.764  1.00  0.00           H  
HETATM   71  H   UNL     1       5.606  -0.295   0.102  1.00  0.00           H  
CONECT    1    2   39   40   41                                       
CONECT    2    7    1    3   42                                       
CONECT    3    2    4   43   44                                       
CONECT    4    5    3   45   46                                       
CONECT    5    6    8    4   47                                       
CONECT    6    7    5   48   49                                       
CONECT    7    6    2   50   51                                       
CONECT    8   24    5   23   52                                       
CONECT    9   25   25   12   24                                       
CONECT   10   32   26   26   11                                       
CONECT   11   10   12   12   53                                       
CONECT   12   11   11    9   27                                       
CONECT   13   27   27   24   28                                       
CONECT   14   29   15   54   55                                       
CONECT   15   14   56   57   58                                       
CONECT   16   30   31   59   60                                       
CONECT   17   34   34   35   33                                       
CONECT   18   19   25   22   22                                       
CONECT   19   20   20   18   61                                       
CONECT   20   37   19   19   21                                       
CONECT   21   20   38   38   62                                       
CONECT   22   18   18   38   63                                       
CONECT   23    8   64   65   66                                       
CONECT   24    9   13    8                                            
CONECT   25   26   18    9    9                                       
CONECT   26   10   10   25                                            
CONECT   27   12   13   13                                            
CONECT   28   13   30   29   67                                       
CONECT   29   28   14                                                 
CONECT   30   16   28   31   68                                       
CONECT   31   16   30   69   70                                       
CONECT   32   36   36   33   10                                       
CONECT   33   17   32   71                                            
CONECT   34   17   17                                                 
CONECT   35   17   36                                                 
CONECT   36   35   32   32                                            
CONECT   37   20                                                      
CONECT   38   21   21   22                                            
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    3                                                      
CONECT   44    3                                                      
CONECT   45    4                                                      
CONECT   46    4                                                      
CONECT   47    5                                                      
CONECT   48    6                                                      
CONECT   49    6                                                      
CONECT   50    7                                                      
CONECT   51    7                                                      
CONECT   52    8                                                      
CONECT   53   11                                                      
CONECT   54   14                                                      
CONECT   55   14                                                      
CONECT   56   15                                                      
CONECT   57   15                                                      
CONECT   58   15                                                      
CONECT   59   16                                                      
CONECT   60   16                                                      
CONECT   61   19                                                      
CONECT   62   21                                                      
CONECT   63   22                                                      
CONECT   64   23                                                      
CONECT   65   23                                                      
CONECT   66   23                                                      
CONECT   67   28                                                      
CONECT   68   30                                                      
CONECT   69   31                                                      
CONECT   70   31                                                      
CONECT   71   33                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
