COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.299  -1.522   0.646  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.248  -0.753   0.182  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.253  -3.486  -0.236  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.258  -4.975  -0.468  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.207  -2.716  -0.709  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.202  -1.350  -0.496  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.243   0.736   0.415  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.926   1.322  -0.024  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.398   1.394  -0.361  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.302   2.074   0.688  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.366   2.313   1.899  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.486   1.038   1.908  1.00  0.00           C  
HETATM   13  C   UNL     1       0.139   1.745  -0.207  1.00  0.00           C  
HETATM   14  C   UNL     1       1.637   1.759  -0.044  1.00  0.00           C  
HETATM   15  C   UNL     1       2.036   1.175  -2.360  1.00  0.00           C  
HETATM   16  C   UNL     1       3.666   0.593  -0.666  1.00  0.00           C  
HETATM   17  C   UNL     1       3.820  -0.185   0.642  1.00  0.00           C  
HETATM   18  C   UNL     1       7.278  -1.215   0.536  1.00  0.00           C  
HETATM   19  C   UNL     1       7.211  -0.607   1.794  1.00  0.00           C  
HETATM   20  C   UNL     1       5.945  -0.163   1.975  1.00  0.00           C  
HETATM   21  C   UNL     1       2.213  -0.045  -3.265  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.301  -2.888   0.437  1.00  0.00           C  
HETATM   23  N   UNL     1      -1.756   2.238  -0.930  1.00  0.00           N  
HETATM   24  N   UNL     1      -0.712   0.997   0.453  1.00  0.00           N  
HETATM   25  N   UNL     1       2.238   0.780  -0.959  1.00  0.00           N  
HETATM   26  N   UNL     1       5.237  -0.480   0.871  1.00  0.00           N  
HETATM   27  N   UNL     1       6.096  -1.135  -0.020  1.00  0.00           N  
HETATM   28  O   UNL     1      -0.576   2.494  -1.051  1.00  0.00           O  
HETATM   29  H   UNL     1      -5.117  -1.055   1.176  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.755  -5.474   0.360  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.286  -5.329  -0.535  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.735  -5.199  -1.398  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.393  -3.181  -1.246  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.381  -0.750  -0.859  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.006   2.139  -1.054  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.962   0.637  -0.905  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.682   3.022   0.308  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.126   1.416   0.965  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.755   3.203   1.745  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.940   2.395   2.822  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.016   0.213   2.383  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.541   1.230   2.417  1.00  0.00           H  
HETATM   43  H   UNL     1       2.019   2.754  -0.274  1.00  0.00           H  
HETATM   44  H   UNL     1       1.893   1.500   0.984  1.00  0.00           H  
HETATM   45  H   UNL     1       2.766   1.938  -2.631  1.00  0.00           H  
HETATM   46  H   UNL     1       1.029   1.576  -2.482  1.00  0.00           H  
HETATM   47  H   UNL     1       4.148   1.566  -0.570  1.00  0.00           H  
HETATM   48  H   UNL     1       4.133   0.035  -1.478  1.00  0.00           H  
HETATM   49  H   UNL     1       3.435   0.414   1.468  1.00  0.00           H  
HETATM   50  H   UNL     1       3.260  -1.118   0.578  1.00  0.00           H  
HETATM   51  H   UNL     1       8.155  -1.669   0.098  1.00  0.00           H  
HETATM   52  H   UNL     1       8.025  -0.509   2.497  1.00  0.00           H  
HETATM   53  H   UNL     1       5.569   0.352   2.847  1.00  0.00           H  
HETATM   54  H   UNL     1       2.148   0.263  -4.308  1.00  0.00           H  
HETATM   55  H   UNL     1       3.187  -0.497  -3.080  1.00  0.00           H  
HETATM   56  H   UNL     1       1.429  -0.772  -3.052  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.119  -3.490   0.808  1.00  0.00           H  
CONECT    1   22    2    2   29                                       
CONECT    2    1    1    6    7                                       
CONECT    3    4   22   22    5                                       
CONECT    4    3   30   31   32                                       
CONECT    5    3    6    6   33                                       
CONECT    6    5    5    2   34                                       
CONECT    7    2   12    9    8                                       
CONECT    8    7   24   23   23                                       
CONECT    9    7   10   35   36                                       
CONECT   10    9   11   37   38                                       
CONECT   11   12   10   39   40                                       
CONECT   12    7   11   41   42                                       
CONECT   13   24   24   14   28                                       
CONECT   14   25   13   43   44                                       
CONECT   15   21   25   45   46                                       
CONECT   16   25   17   47   48                                       
CONECT   17   16   26   49   50                                       
CONECT   18   27   27   19   51                                       
CONECT   19   18   20   20   52                                       
CONECT   20   26   19   19   53                                       
CONECT   21   15   54   55   56                                       
CONECT   22    3    3    1   57                                       
CONECT   23    8    8   28                                            
CONECT   24    8   13   13                                            
CONECT   25   15   16   14                                            
CONECT   26   17   27   20                                            
CONECT   27   26   18   18                                            
CONECT   28   13   23                                                 
CONECT   29    1                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   21                                                      
CONECT   57   22                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
