COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.705   1.307  -0.256  1.00  0.00           C  
HETATM    2  C   UNL     1       1.984   0.624  -0.014  1.00  0.00           C  
HETATM    3  C   UNL     1       1.408  -1.732  -0.306  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.137   1.753  -0.391  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.362  -1.089  -0.547  1.00  0.00           C  
HETATM    6  C   UNL     1       5.200  -1.240   0.164  1.00  0.00           C  
HETATM    7  C   UNL     1       5.860  -1.402   1.325  1.00  0.00           C  
HETATM    8  C   UNL     1       7.337  -1.322  -0.326  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.673  -0.497  -1.064  1.00  0.00           C  
HETATM   10  C   UNL     1       7.237  -1.455   1.009  1.00  0.00           C  
HETATM   11  C   UNL     1       3.705  -1.130   0.008  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.444   1.028  -0.424  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.368  -0.084   0.001  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.842  -0.131   1.299  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.744  -1.055  -0.908  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.592  -2.075  -0.518  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.689  -1.152   1.689  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.062  -2.125   0.781  1.00  0.00           C  
HETATM   19  N   UNL     1       1.610   1.934   0.071  1.00  0.00           N  
HETATM   20  C   UNL     1       0.290   2.290  -0.045  1.00  0.00           C  
HETATM   21  C   UNL     1       1.021  -0.356  -0.216  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.348   0.005  -0.335  1.00  0.00           C  
HETATM   23  N   UNL     1       0.238   3.606   0.077  1.00  0.00           N  
HETATM   24  N   UNL     1       1.424   4.070   0.258  1.00  0.00           N  
HETATM   25  N   UNL     1       3.307   0.277   0.100  1.00  0.00           N  
HETATM   26  C   UNL     1       2.297   3.098   0.263  1.00  0.00           C  
HETATM   27  N   UNL     1      -3.051   0.625  -0.189  1.00  0.00           N  
HETATM   28  N   UNL     1       1.716  -2.823  -0.377  1.00  0.00           N  
HETATM   29  O   UNL     1       6.100  -1.187  -0.832  1.00  0.00           O  
HETATM   30  H   UNL     1      -2.345   2.522   0.352  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.291   2.166  -1.388  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.544  -1.601   0.398  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.977  -1.803  -1.276  1.00  0.00           H  
HETATM   34  H   UNL     1       5.422  -1.476   2.309  1.00  0.00           H  
HETATM   35  H   UNL     1       8.255  -1.320  -0.893  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.537  -0.138  -2.084  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.453  -1.258  -1.043  1.00  0.00           H  
HETATM   38  H   UNL     1       8.053  -1.582   1.706  1.00  0.00           H  
HETATM   39  H   UNL     1       3.411  -1.528  -0.963  1.00  0.00           H  
HETATM   40  H   UNL     1       3.215  -1.699   0.798  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.589   1.236  -1.484  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.665   1.925   0.155  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.551   0.630   2.008  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.377  -1.016  -1.923  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.886  -2.834  -1.229  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.059  -1.188   2.702  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.723  -2.922   1.085  1.00  0.00           H  
HETATM   48  H   UNL     1       3.978   0.963   0.241  1.00  0.00           H  
HETATM   49  H   UNL     1       3.364   3.197   0.394  1.00  0.00           H  
CONECT    1    4   22   22   20                                       
CONECT    2   21   21   19   25                                       
CONECT    3   28   28   28   21                                       
CONECT    4   27    1   30   31                                       
CONECT    5    9   22   32   33                                       
CONECT    6   29   11    7    7                                       
CONECT    7    6    6   10   34                                       
CONECT    8   29   10   10   35                                       
CONECT    9   27    5   36   37                                       
CONECT   10    8    8    7   38                                       
CONECT   11   25    6   39   40                                       
CONECT   12   13   27   41   42                                       
CONECT   13   14   14   15   12                                       
CONECT   14   17   13   13   43                                       
CONECT   15   16   16   13   44                                       
CONECT   16   18   15   15   45                                       
CONECT   17   18   18   14   46                                       
CONECT   18   17   17   16   47                                       
CONECT   19   20    2   26                                            
CONECT   20    1   23   23   19                                       
CONECT   21   22    3    2    2                                       
CONECT   22    5    1    1   21                                       
CONECT   23   20   20   24                                            
CONECT   24   23   26   26                                            
CONECT   25    2   11   48                                            
CONECT   26   19   24   24   49                                       
CONECT   27   12    9    4                                            
CONECT   28    3    3    3                                            
CONECT   29    8    6                                                 
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
