COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -4.623  -0.157   0.693  1.00  0.00           N  
HETATM    2  C   UNL     1      -4.044   1.057   0.775  1.00  0.00           C  
HETATM    3  N   UNL     1       5.653  -1.789   2.669  1.00  0.00           N  
HETATM    4  C   UNL     1      -3.796   3.477   0.294  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.049  -1.293   1.418  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.032  -2.007   0.525  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.010  -2.905  -1.029  1.00  0.00           C  
HETATM    8  C   UNL     1       0.004  -3.394  -1.831  1.00  0.00           C  
HETATM    9  C   UNL     1       1.096  -2.600  -2.133  1.00  0.00           C  
HETATM   10  C   UNL     1       1.178  -1.314  -1.632  1.00  0.00           C  
HETATM   11  C   UNL     1       0.164  -0.817  -0.827  1.00  0.00           C  
HETATM   12  C   UNL     1       1.385   1.149  -0.558  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.830  -0.340  -0.117  1.00  0.00           C  
HETATM   14  C   UNL     1       1.371   2.250  -1.361  1.00  0.00           C  
HETATM   15  C   UNL     1       2.561   2.969  -1.578  1.00  0.00           C  
HETATM   16  C   UNL     1       3.712   2.579  -1.001  1.00  0.00           C  
HETATM   17  C   UNL     1       2.604   0.747   0.046  1.00  0.00           C  
HETATM   18  C   UNL     1       2.915  -0.301   0.887  1.00  0.00           C  
HETATM   19  C   UNL     1       4.294  -0.206   1.171  1.00  0.00           C  
HETATM   20  C   UNL     1       5.052  -1.089   2.006  1.00  0.00           C  
HETATM   21  C   UNL     1       4.778   0.897   0.494  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.639   2.227   0.034  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.934  -1.617  -0.524  1.00  0.00           C  
HETATM   24  N   UNL     1       3.753   1.471  -0.186  1.00  0.00           N  
HETATM   25  O   UNL     1      -3.045   1.209   1.445  1.00  0.00           O  
HETATM   26  O   UNL     1      -1.933  -1.133   0.261  1.00  0.00           O  
HETATM   27  O   UNL     1       0.244   0.447  -0.334  1.00  0.00           O  
HETATM   28  H   UNL     1      -3.784   3.692   1.362  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.777   3.307  -0.054  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.226   4.323  -0.243  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.552  -0.934   2.320  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.842  -1.988   1.693  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.670  -2.902   1.031  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.508  -2.287  -0.415  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.863  -3.526  -0.799  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.056  -4.398  -2.224  1.00  0.00           H  
HETATM   37  H   UNL     1       1.886  -2.985  -2.760  1.00  0.00           H  
HETATM   38  H   UNL     1       2.032  -0.696  -1.868  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.548  -0.608  -1.135  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.438  -1.136   0.312  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.402   0.588  -0.131  1.00  0.00           H  
HETATM   42  H   UNL     1       0.451   2.569  -1.829  1.00  0.00           H  
HETATM   43  H   UNL     1       2.550   3.841  -2.215  1.00  0.00           H  
HETATM   44  H   UNL     1       4.616   3.144  -1.179  1.00  0.00           H  
HETATM   45  H   UNL     1       2.233  -1.052   1.258  1.00  0.00           H  
HETATM   46  H   UNL     1       5.800   1.244   0.505  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.650   2.012  -1.035  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.658   2.397   0.381  1.00  0.00           H  
CONECT    1    5    2   13                                            
CONECT    2   22    1   25   25                                       
CONECT    3   20   20   20                                            
CONECT    4   22   28   29   30                                       
CONECT    5    6    1   31   32                                       
CONECT    6   26    5   33   34                                       
CONECT    7    8    8   23   35                                       
CONECT    8    7    7    9   36                                       
CONECT    9    8   10   10   37                                       
CONECT   10    9    9   11   38                                       
CONECT   11   23   23   10   27                                       
CONECT   12   27   14   14   17                                       
CONECT   13    1   39   40   41                                       
CONECT   14   12   12   15   42                                       
CONECT   15   14   16   16   43                                       
CONECT   16   15   15   24   44                                       
CONECT   17   12   18   18   24                                       
CONECT   18   17   17   19   45                                       
CONECT   19   18   21   21   20                                       
CONECT   20   19    3    3    3                                       
CONECT   21   24   19   19   46                                       
CONECT   22    4    2   47   48                                       
CONECT   23    7   26   11   11                                       
CONECT   24   17   16   21                                            
CONECT   25    2    2                                                 
CONECT   26   23    6                                                 
CONECT   27   11   12                                                 
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   18                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
