COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.289   0.220  -0.357  1.00  0.00           C  
HETATM    2  N   UNL     1       2.674   0.305   0.766  1.00  0.00           N  
HETATM    3  O   UNL     1      -4.254   2.208  -0.043  1.00  0.00           O  
HETATM    4  N   UNL     1       6.246   0.039   0.248  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.082   1.133  -0.123  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.859   3.500  -0.124  1.00  0.00           C  
HETATM    7  N   UNL     1      -2.175   0.607   0.215  1.00  0.00           N  
HETATM    8  C   UNL     1      -6.771  -1.067  -0.275  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.413  -1.259  -0.118  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.559  -0.161  -0.041  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.099  -0.364   0.128  1.00  0.00           C  
HETATM   12  C   UNL     1       0.307   0.615   0.494  1.00  0.00           C  
HETATM   13  C   UNL     1       1.393  -0.222   0.632  1.00  0.00           C  
HETATM   14  C   UNL     1       4.496   1.798   0.327  1.00  0.00           C  
HETATM   15  C   UNL     1       5.080   0.530   0.995  1.00  0.00           C  
HETATM   16  C   UNL     1       3.911  -0.475   0.913  1.00  0.00           C  
HETATM   17  C   UNL     1       1.195  -1.620   0.634  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.046  -2.128   0.503  1.00  0.00           C  
HETATM   19 CL   UNL     1      -7.833  -2.436  -0.371  1.00  0.00          Cl  
HETATM   20  O   UNL     1      -8.627   0.403  -0.512  1.00  0.00           O  
HETATM   21  C   UNL     1      -9.093   1.752  -0.583  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.445   1.317  -0.276  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.977   0.056   0.360  1.00  0.00           C  
HETATM   24  N   UNL     1      -1.129  -1.308   0.366  1.00  0.00           N  
HETATM   25  C   UNL     1      -2.468  -1.566   0.220  1.00  0.00           C  
HETATM   26  C   UNL     1       3.015   1.739   0.778  1.00  0.00           C  
HETATM   27  H   UNL     1       6.330  -0.964   0.328  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.089   4.267  -0.047  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.377   3.600  -1.078  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.573   3.619   0.691  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.013  -2.260  -0.054  1.00  0.00           H  
HETATM   32  H   UNL     1       0.440   1.687   0.491  1.00  0.00           H  
HETATM   33  H   UNL     1       4.983   2.699   0.700  1.00  0.00           H  
HETATM   34  H   UNL     1       4.577   1.735  -0.758  1.00  0.00           H  
HETATM   35  H   UNL     1       5.344   0.727   2.033  1.00  0.00           H  
HETATM   36  H   UNL     1       3.868  -1.069   1.826  1.00  0.00           H  
HETATM   37  H   UNL     1       4.043  -1.128   0.050  1.00  0.00           H  
HETATM   38  H   UNL     1       2.040  -2.283   0.740  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.186  -3.199   0.506  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.830   2.276   0.336  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.628   2.253  -1.432  1.00  0.00           H  
HETATM   42  H   UNL     1     -10.176   1.756  -0.706  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.852   2.316  -0.336  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.933  -2.540   0.185  1.00  0.00           H  
HETATM   45  H   UNL     1       2.383   2.286   0.078  1.00  0.00           H  
HETATM   46  H   UNL     1       2.909   2.146   1.784  1.00  0.00           H  
HETATM   47  C   UNL     1       7.475   0.708   0.693  1.00  0.00           C  
HETATM   48  C   UNL     1       8.647   0.180  -0.094  1.00  0.00           C  
HETATM   49  C   UNL     1       9.033   0.781  -1.283  1.00  0.00           C  
HETATM   50  C   UNL     1      10.113   0.269  -1.976  1.00  0.00           C  
HETATM   51  N   UNL     1      10.773  -0.778  -1.520  1.00  0.00           N  
HETATM   52  C   UNL     1      10.435  -1.374  -0.394  1.00  0.00           C  
HETATM   53  C   UNL     1       9.369  -0.915   0.357  1.00  0.00           C  
HETATM   54  H   UNL     1       7.384   1.782   0.531  1.00  0.00           H  
HETATM   55  H   UNL     1       7.632   0.512   1.753  1.00  0.00           H  
HETATM   56  H   UNL     1       8.496   1.637  -1.662  1.00  0.00           H  
HETATM   57  H   UNL     1      10.420   0.731  -2.903  1.00  0.00           H  
HETATM   58  H   UNL     1      10.999  -2.229  -0.052  1.00  0.00           H  
HETATM   59  H   UNL     1       9.097  -1.407   1.279  1.00  0.00           H  
CONECT    1    8   20   22   22                                       
CONECT    2   16   13   26                                            
CONECT    3    5    6                                                 
CONECT    4   15   27   47                                            
CONECT    5   10   10   22    3                                       
CONECT    6    3   28   29   30                                       
CONECT    7   11   23   23                                            
CONECT    8   19    9    9    1                                       
CONECT    9    8    8   10   31                                       
CONECT   10    9   11    5    5                                       
CONECT   11   25   25   10    7                                       
CONECT   12   13   13   23   32                                       
CONECT   13   17    2   12   12                                       
CONECT   14   15   26   33   34                                       
CONECT   15   16    4   14   35                                       
CONECT   16   15    2   36   37                                       
CONECT   17   18   18   13   38                                       
CONECT   18   17   17   24   39                                       
CONECT   19    8                                                      
CONECT   20    1   21                                                 
CONECT   21   20   40   41   42                                       
CONECT   22    1    1    5   43                                       
CONECT   23   24   12    7    7                                       
CONECT   24   18   25   23                                            
CONECT   25   24   11   11   44                                       
CONECT   26    2   14   45   46                                       
CONECT   27    4                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31    9                                                      
CONECT   32   12                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47    4   48   54   55                                       
CONECT   48   47   49   53   53                                       
CONECT   49   48   50   50   56                                       
CONECT   50   49   49   51   57                                       
CONECT   51   50   52   52                                            
CONECT   52   51   51   53   58                                       
CONECT   53   52   48   48   59                                       
CONECT   54   47                                                      
CONECT   55   47                                                      
CONECT   56   49                                                      
CONECT   57   50                                                      
CONECT   58   52                                                      
CONECT   59   53                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
