COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.125  -0.552  -0.687  1.00  0.00           N  
HETATM    2  C   UNL     1       3.302  -1.478   0.096  1.00  0.00           C  
HETATM    3  C   UNL     1       1.737  -3.420  -0.042  1.00  0.00           C  
HETATM    4  C   UNL     1       2.707  -2.539  -0.831  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.017   0.552  -0.213  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.241   1.854   0.258  1.00  0.00           C  
HETATM    7  C   UNL     1       2.309   1.083  -0.544  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.945  -0.907   0.156  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.338  -0.651  -0.530  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.858  -1.377   1.700  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.693  -0.724  -0.262  1.00  0.00           C  
HETATM   12  C   UNL     1      -8.130  -1.125   0.987  1.00  0.00           C  
HETATM   13  C   UNL     1       1.261   0.170  -0.617  1.00  0.00           C  
HETATM   14  C   UNL     1       8.681  -1.204   0.679  1.00  0.00           C  
HETATM   15  C   UNL     1       7.930  -0.931  -0.648  1.00  0.00           C  
HETATM   16  O   UNL     1       7.728  -1.875   1.519  1.00  0.00           O  
HETATM   17  C   UNL     1       6.396  -1.544   1.108  1.00  0.00           C  
HETATM   18  C   UNL     1       6.503  -0.615  -0.120  1.00  0.00           C  
HETATM   19  C   UNL     1       5.445  -0.971  -1.166  1.00  0.00           C  
HETATM   20  C   UNL     1       3.666   0.683  -0.970  1.00  0.00           C  
HETATM   21  O   UNL     1       4.368   1.468  -1.577  1.00  0.00           O  
HETATM   22  C   UNL     1       2.079   2.380  -0.070  1.00  0.00           C  
HETATM   23  C   UNL     1       0.813   2.761   0.326  1.00  0.00           C  
HETATM   24  O   UNL     1       0.595   4.023   0.783  1.00  0.00           O  
HETATM   25  C   UNL     1       1.695   4.934   0.723  1.00  0.00           C  
HETATM   26  O   UNL     1      -1.556   1.928   0.564  1.00  0.00           O  
HETATM   27  N   UNL     1      -1.217  -0.092  -0.165  1.00  0.00           N  
HETATM   28  C   UNL     1      -2.118   0.736   0.297  1.00  0.00           C  
HETATM   29  N   UNL     1      -3.447   0.431   0.484  1.00  0.00           N  
HETATM   30  C   UNL     1      -5.421  -0.980   0.450  1.00  0.00           C  
HETATM   31 CL   UNL     1      -8.845  -0.310  -1.493  1.00  0.00          Cl  
HETATM   32  C   UNL     1      -7.212  -1.455   1.967  1.00  0.00           C  
HETATM   33  H   UNL     1       3.919  -1.961   0.853  1.00  0.00           H  
HETATM   34  H   UNL     1       2.497  -0.926   0.581  1.00  0.00           H  
HETATM   35  H   UNL     1       2.287  -3.976   0.718  1.00  0.00           H  
HETATM   36  H   UNL     1       0.986  -2.793   0.440  1.00  0.00           H  
HETATM   37  H   UNL     1       1.247  -4.119  -0.720  1.00  0.00           H  
HETATM   38  H   UNL     1       2.173  -2.051  -1.647  1.00  0.00           H  
HETATM   39  H   UNL     1       3.508  -3.156  -1.240  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.774  -1.109  -0.901  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.417  -1.648   0.757  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.996  -0.342  -1.507  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.141  -1.634   2.466  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.188  -1.182   1.197  1.00  0.00           H  
HETATM   45  H   UNL     1       1.437  -0.830  -0.985  1.00  0.00           H  
HETATM   46  H   UNL     1       9.544  -1.844   0.500  1.00  0.00           H  
HETATM   47  H   UNL     1       8.994  -0.266   1.138  1.00  0.00           H  
HETATM   48  H   UNL     1       8.354  -0.074  -1.171  1.00  0.00           H  
HETATM   49  H   UNL     1       7.925  -1.815  -1.286  1.00  0.00           H  
HETATM   50  H   UNL     1       5.855  -2.451   0.840  1.00  0.00           H  
HETATM   51  H   UNL     1       5.877  -1.030   1.918  1.00  0.00           H  
HETATM   52  H   UNL     1       6.422   0.431   0.176  1.00  0.00           H  
HETATM   53  H   UNL     1       5.446  -2.048  -1.332  1.00  0.00           H  
HETATM   54  H   UNL     1       5.671  -0.458  -2.101  1.00  0.00           H  
HETATM   55  H   UNL     1       2.896   3.085  -0.014  1.00  0.00           H  
HETATM   56  H   UNL     1       1.410   5.878   1.187  1.00  0.00           H  
HETATM   57  H   UNL     1       2.546   4.510   1.255  1.00  0.00           H  
HETATM   58  H   UNL     1       1.966   5.108  -0.318  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.054   1.102   0.833  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.553  -1.769   2.943  1.00  0.00           H  
CONECT    1   19    2   20                                            
CONECT    2    4    1   33   34                                       
CONECT    3    4   35   36   37                                       
CONECT    4    3    2   38   39                                       
CONECT    5   13   27    6    6                                       
CONECT    6    5    5   23   26                                       
CONECT    7   20   13   13   22                                       
CONECT    8   30   29   40   41                                       
CONECT    9   11   30   30   42                                       
CONECT   10   32   32   30   43                                       
CONECT   11   31   12   12    9                                       
CONECT   12   11   11   32   44                                       
CONECT   13    7    7    5   45                                       
CONECT   14   15   16   46   47                                       
CONECT   15   14   18   48   49                                       
CONECT   16   14   17                                                 
CONECT   17   18   16   50   51                                       
CONECT   18   15   17   19   52                                       
CONECT   19   18    1   53   54                                       
CONECT   20    1   21   21    7                                       
CONECT   21   20   20                                                 
CONECT   22    7   23   23   55                                       
CONECT   23   22   22    6   24                                       
CONECT   24   23   25                                                 
CONECT   25   24   56   57   58                                       
CONECT   26    6   28                                                 
CONECT   27    5   28   28                                            
CONECT   28   27   27   26   29                                       
CONECT   29   28    8   59                                            
CONECT   30    9    9   10    8                                       
CONECT   31   11                                                      
CONECT   32   12   10   10   60                                       
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   15                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   22                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   25                                                      
CONECT   59   29                                                      
CONECT   60   32                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
