COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.489  -2.182   0.231  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.155  -2.138   0.055  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.633  -1.228   0.989  1.00  0.00           C  
HETATM    4  O   UNL     1       4.962  -1.821  -0.158  1.00  0.00           O  
HETATM    5  C   UNL     1      -3.319  -2.819  -0.818  1.00  0.00           C  
HETATM    6  O   UNL     1       6.030   0.569   0.647  1.00  0.00           O  
HETATM    7  C   UNL     1      -1.970  -2.519  -0.768  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.445  -1.560   0.101  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.764  -1.666   1.542  1.00  0.00           C  
HETATM   10  O   UNL     1      -4.666  -0.760   1.719  1.00  0.00           O  
HETATM   11  C   UNL     1       5.372  -1.913  -1.523  1.00  0.00           C  
HETATM   12  C   UNL     1       4.144  -0.786   0.173  1.00  0.00           C  
HETATM   13  C   UNL     1       2.747  -0.930   0.102  1.00  0.00           C  
HETATM   14  C   UNL     1       1.909   0.167   0.440  1.00  0.00           C  
HETATM   15  C   UNL     1       2.491   1.368   0.869  1.00  0.00           C  
HETATM   16  C   UNL     1       3.849   1.484   0.930  1.00  0.00           C  
HETATM   17  C   UNL     1       4.680   0.420   0.582  1.00  0.00           C  
HETATM   18  C   UNL     1       6.522   1.840   1.078  1.00  0.00           C  
HETATM   19  C   UNL     1       0.516  -0.008   0.332  1.00  0.00           C  
HETATM   20  C   UNL     1       0.007  -1.256   0.046  1.00  0.00           C  
HETATM   21  N   UNL     1       0.838  -2.243  -0.343  1.00  0.00           N1+
HETATM   22  C   UNL     1       2.145  -2.126  -0.305  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.280  -0.938   1.037  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.012  -3.268  -1.667  1.00  0.00           C  
HETATM   25  C   UNL     1       0.284  -3.494  -0.881  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.375   1.205   0.450  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.480   1.895  -0.911  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.370   3.106  -0.794  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.841   4.347  -0.472  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.687   5.435  -0.373  1.00  0.00           C  
HETATM   31  N   UNL     1      -2.983   5.302  -0.581  1.00  0.00           N  
HETATM   32  C   UNL     1      -3.520   4.138  -0.889  1.00  0.00           C  
HETATM   33  C   UNL     1      -2.736   3.007  -1.010  1.00  0.00           C  
HETATM   34  H   UNL     1      -3.708  -3.554  -1.508  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.717  -1.137   1.563  1.00  0.00           H  
HETATM   36  H   UNL     1       6.019  -2.780  -1.651  1.00  0.00           H  
HETATM   37  H   UNL     1       4.494  -2.018  -2.160  1.00  0.00           H  
HETATM   38  H   UNL     1       5.916  -1.010  -1.801  1.00  0.00           H  
HETATM   39  H   UNL     1       1.887   2.214   1.162  1.00  0.00           H  
HETATM   40  H   UNL     1       4.285   2.418   1.252  1.00  0.00           H  
HETATM   41  H   UNL     1       7.612   1.824   1.085  1.00  0.00           H  
HETATM   42  H   UNL     1       6.174   2.615   0.395  1.00  0.00           H  
HETATM   43  H   UNL     1       6.155   2.050   2.083  1.00  0.00           H  
HETATM   44  H   UNL     1       2.763  -2.966  -0.591  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.897  -0.290   1.813  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.442  -4.226  -1.944  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.802  -2.675  -2.553  1.00  0.00           H  
HETATM   48  H   UNL     1       1.018  -3.950  -1.542  1.00  0.00           H  
HETATM   49  H   UNL     1       0.077  -4.171  -0.055  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.367   0.896   0.779  1.00  0.00           H  
HETATM   51  H   UNL     1       0.049   1.898   1.177  1.00  0.00           H  
HETATM   52  H   UNL     1       0.512   2.204  -1.240  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.904   1.202  -1.638  1.00  0.00           H  
HETATM   54  H   UNL     1       0.219   4.461  -0.300  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.283   6.404  -0.123  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.586   4.068  -1.051  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.181   2.056  -1.263  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.743  -2.461   2.288  1.00  0.00           H  
CONECT    1    9    2                                                 
CONECT    2    1    3    3    5                                       
CONECT    3    2    2   10   23                                       
CONECT    4   11   12                                                 
CONECT    5    2    7    7   34                                       
CONECT    6   18   17                                                 
CONECT    7    5    5    8   24                                       
CONECT    8   23   23    7   20                                       
CONECT    9    1   10   35   58                                       
CONECT   10    9    3                                                 
CONECT   11    4   36   37   38                                       
CONECT   12   17   17   13    4                                       
CONECT   13   14   12   22   22                                       
CONECT   14   15   19   19   13                                       
CONECT   15   16   16   14   39                                       
CONECT   16   15   15   17   40                                       
CONECT   17   16    6   12   12                                       
CONECT   18    6   41   42   43                                       
CONECT   19   26   14   14   20                                       
CONECT   20   19    8   21   21                                       
CONECT   21   25   20   20   22                                       
CONECT   22   13   13   21   44                                       
CONECT   23    3    8    8   45                                       
CONECT   24   25    7   46   47                                       
CONECT   25   21   24   48   49                                       
CONECT   26   19   27   50   51                                       
CONECT   27   26   28   52   53                                       
CONECT   28   33   33   29   27                                       
CONECT   29   30   30   28   54                                       
CONECT   30   31   29   29   55                                       
CONECT   31   32   32   30                                            
CONECT   32   31   31   33   56                                       
CONECT   33   32   28   28   57                                       
CONECT   34    5                                                      
CONECT   35    9                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   32                                                      
CONECT   57   33                                                      
CONECT   58    9                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
