COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.738   0.699   0.101  1.00  0.00           N  
HETATM    2  N   UNL     1      -2.822   2.747  -1.862  1.00  0.00           N  
HETATM    3  C   UNL     1       0.778  -0.279   1.225  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.221   0.654   0.591  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.408   1.093  -0.230  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.978   1.958  -1.213  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.111   2.764  -1.619  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.029   1.908  -0.345  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.309   0.211   1.065  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.786   1.060   0.081  1.00  0.00           C  
HETATM   11  C   UNL     1       0.223  -2.633   0.560  1.00  0.00           C  
HETATM   12  C   UNL     1       2.078  -2.554  -1.514  1.00  0.00           C  
HETATM   13  C   UNL     1       1.895  -1.446  -0.691  1.00  0.00           C  
HETATM   14  C   UNL     1       2.668  -0.203  -0.898  1.00  0.00           C  
HETATM   15  O   UNL     1       3.233   0.002  -1.955  1.00  0.00           O  
HETATM   16  C   UNL     1       3.451   1.960  -0.118  1.00  0.00           C  
HETATM   17  C   UNL     1       4.868   1.829   0.378  1.00  0.00           C  
HETATM   18  O   UNL     1       5.272   0.759   0.782  1.00  0.00           O  
HETATM   19  N   UNL     1       5.686   2.900   0.373  1.00  0.00           N  
HETATM   20  C   UNL     1       7.064   2.772   0.855  1.00  0.00           C  
HETATM   21  C   UNL     1       1.339  -3.699  -1.290  1.00  0.00           C  
HETATM   22  C   UNL     1       0.406  -3.735  -0.261  1.00  0.00           C  
HETATM   23 CL   UNL     1      -0.523  -5.176   0.009  1.00  0.00          Cl  
HETATM   24  C   UNL     1       0.959  -1.489   0.349  1.00  0.00           C  
HETATM   25  C   UNL     1       2.111   0.445   1.395  1.00  0.00           C  
HETATM   26  O   UNL     1       0.129   1.752   0.213  1.00  0.00           O  
HETATM   27  N   UNL     1      -1.504   0.268   0.442  1.00  0.00           N  
HETATM   28  C   UNL     1      -3.398  -0.709   1.836  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.647   0.225   1.320  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.503   1.070   0.617  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.655   1.921  -0.636  1.00  0.00           C  
HETATM   32  H   UNL     1       0.409  -0.592   2.202  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.927   1.993  -1.461  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.755   3.428  -2.176  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.705   2.558  -0.882  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.497  -2.672   1.364  1.00  0.00           H  
HETATM   37  H   UNL     1       2.793  -2.519  -2.322  1.00  0.00           H  
HETATM   38  H   UNL     1       3.459   2.193  -1.183  1.00  0.00           H  
HETATM   39  H   UNL     1       2.949   2.761   0.426  1.00  0.00           H  
HETATM   40  H   UNL     1       5.363   3.755   0.050  1.00  0.00           H  
HETATM   41  H   UNL     1       7.568   3.735   0.775  1.00  0.00           H  
HETATM   42  H   UNL     1       7.056   2.451   1.897  1.00  0.00           H  
HETATM   43  H   UNL     1       7.593   2.033   0.252  1.00  0.00           H  
HETATM   44  H   UNL     1       1.477  -4.562  -1.925  1.00  0.00           H  
HETATM   45  H   UNL     1       2.777  -0.169   2.001  1.00  0.00           H  
HETATM   46  H   UNL     1       1.941   1.395   1.903  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.799  -0.583   0.803  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.591  -0.130   2.285  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.966  -1.210   2.620  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.977  -1.454   1.160  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.050  -0.430   2.079  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.560   1.061   0.840  1.00  0.00           H  
CONECT    1   25   16   14                                            
CONECT    2    7    6    6                                            
CONECT    3    4   25   24   32                                       
CONECT    4   27    3   26   26                                       
CONECT    5   10   10    6   27                                       
CONECT    6    2    2    5   33                                       
CONECT    7   31   31    2   34                                       
CONECT    8   30   30   31   35                                       
CONECT    9   29   29   10   28                                       
CONECT   10   31    9    5    5                                       
CONECT   11   24   24   22   36                                       
CONECT   12   13   13   21   37                                       
CONECT   13   24   14   12   12                                       
CONECT   14    1   13   15   15                                       
CONECT   15   14   14                                                 
CONECT   16   17    1   38   39                                       
CONECT   17   19   16   18   18                                       
CONECT   18   17   17                                                 
CONECT   19   20   17   40                                            
CONECT   20   19   41   42   43                                       
CONECT   21   22   22   12   44                                       
CONECT   22   11   23   21   21                                       
CONECT   23   22                                                      
CONECT   24    3   11   11   13                                       
CONECT   25    3    1   45   46                                       
CONECT   26    4    4                                                 
CONECT   27    5    4   47                                            
CONECT   28    9   48   49   50                                       
CONECT   29   30    9    9   51                                       
CONECT   30    8    8   29   52                                       
CONECT   31    8    7    7   10                                       
CONECT   32    3                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   25                                                      
CONECT   46   25                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
