COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.522   1.886  -0.513  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.729   2.302   0.265  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.163  -1.549  -0.214  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.789  -1.420   0.450  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.509   0.054   0.750  1.00  0.00           C  
HETATM    6  C   UNL     1       4.073  -0.618   0.251  1.00  0.00           C  
HETATM    7  C   UNL     1       2.824  -2.534   0.979  1.00  0.00           C  
HETATM    8  C   UNL     1       6.990   0.411   0.922  1.00  0.00           C  
HETATM    9  C   UNL     1       5.765   1.268   0.730  1.00  0.00           C  
HETATM   10  C   UNL     1       4.473   0.798   0.433  1.00  0.00           C  
HETATM   11  C   UNL     1       3.643   1.908   0.340  1.00  0.00           C  
HETATM   12  C   UNL     1       2.196   1.899   0.043  1.00  0.00           C  
HETATM   13  C   UNL     1       1.280   2.308   1.014  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.070   2.300   0.733  1.00  0.00           C  
HETATM   15  C   UNL     1       0.382   1.479  -1.485  1.00  0.00           C  
HETATM   16  C   UNL     1       1.738   1.483  -1.214  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.178   2.222  -0.218  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.860   0.762  -1.107  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.191  -0.684  -1.478  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.230  -1.080   0.741  1.00  0.00           C  
HETATM   21  C   UNL     1       3.198  -1.218   1.156  1.00  0.00           C  
HETATM   22  C   UNL     1       3.316  -3.259  -0.094  1.00  0.00           C  
HETATM   23  C   UNL     1       4.189  -2.668  -0.992  1.00  0.00           C  
HETATM   24  C   UNL     1       4.565  -1.351  -0.827  1.00  0.00           C  
HETATM   25  N   UNL     1       4.416   3.005   0.575  1.00  0.00           N  
HETATM   26  N   UNL     1       5.724   2.570   0.817  1.00  0.00           N  
HETATM   27  N   UNL     1      -4.524   0.822  -0.501  1.00  0.00           N1+
HETATM   28  N   UNL     1      -7.391  -1.699   1.928  1.00  0.00           N  
HETATM   29  O   UNL     1       2.624   1.084  -2.164  1.00  0.00           O  
HETATM   30  O   UNL     1      -1.854   1.876  -0.781  1.00  0.00           O  
HETATM   31  O   UNL     1      -7.944  -0.147   0.442  1.00  0.00           O  
HETATM   32 CL   UNL     1       2.841  -4.914  -0.310  1.00  0.00          Cl  
HETATM   33  H   UNL     1      -2.493   3.330   0.540  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.599   1.655   1.133  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.344  -2.590  -0.480  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.779  -1.989   1.380  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.023  -1.808  -0.221  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.276   0.440   1.421  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.532   0.149   1.222  1.00  0.00           H  
HETATM   40  H   UNL     1       2.143  -3.000   1.677  1.00  0.00           H  
HETATM   41  H   UNL     1       7.077   0.131   1.971  1.00  0.00           H  
HETATM   42  H   UNL     1       6.904  -0.488   0.311  1.00  0.00           H  
HETATM   43  H   UNL     1       7.876   0.971   0.621  1.00  0.00           H  
HETATM   44  H   UNL     1       1.628   2.631   1.984  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.778   2.615   1.485  1.00  0.00           H  
HETATM   46  H   UNL     1       0.025   1.159  -2.453  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.841   2.611   0.555  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.292   2.815  -1.126  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.879   1.381  -2.004  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.597   1.133  -0.395  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.454  -1.056  -2.189  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.184  -0.727  -1.926  1.00  0.00           H  
HETATM   53  H   UNL     1       2.814  -0.654   1.993  1.00  0.00           H  
HETATM   54  H   UNL     1       4.569  -3.238  -1.827  1.00  0.00           H  
HETATM   55  H   UNL     1       5.240  -0.889  -1.533  1.00  0.00           H  
HETATM   56  H   UNL     1       4.112   3.926   0.576  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.849   0.433  -1.142  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.820  -2.445   2.167  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.078  -1.397   2.543  1.00  0.00           H  
HETATM   60  H   UNL     1       2.878   1.783  -2.782  1.00  0.00           H  
CONECT    1   30   14   14   15                                       
CONECT    2   17   30   33   34                                       
CONECT    3    4   19   20   35                                       
CONECT    4    5    3   36   37                                       
CONECT    5    4   27   38   39                                       
CONECT    6   21   21   24   10                                       
CONECT    7   22   22   21   40                                       
CONECT    8    9   41   42   43                                       
CONECT    9   10    8   26   26                                       
CONECT   10    6   11   11    9                                       
CONECT   11   12   10   10   25                                       
CONECT   12   13   13   16   11                                       
CONECT   13   14   12   12   44                                       
CONECT   14    1    1   13   45                                       
CONECT   15    1   16   16   46                                       
CONECT   16   15   15   12   29                                       
CONECT   17   27    2   47   48                                       
CONECT   18   27   19   49   50                                       
CONECT   19   18    3   51   52                                       
CONECT   20    3   31   31   28                                       
CONECT   21    7    6    6   53                                       
CONECT   22   32    7    7   23                                       
CONECT   23   22   24   24   54                                       
CONECT   24   23   23    6   55                                       
CONECT   25   11   26   56                                            
CONECT   26    9    9   25                                            
CONECT   27    5   17   18   57                                       
CONECT   28   20   58   59                                            
CONECT   29   16   60                                                 
CONECT   30    2    1                                                 
CONECT   31   20   20                                                 
CONECT   32   22                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   17                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   21                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
