COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.063  -2.511  -0.831  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.817  -1.083  -0.310  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.647   0.781   0.491  1.00  0.00           C  
HETATM    4  C   UNL     1       2.070   0.010   1.146  1.00  0.00           C  
HETATM    5  C   UNL     1       1.574   0.219  -0.151  1.00  0.00           C  
HETATM    6  C   UNL     1       3.373  -0.336   1.042  1.00  0.00           C  
HETATM    7  C   UNL     1       5.010  -0.668  -0.829  1.00  0.00           C  
HETATM    8  C   UNL     1       5.903   0.585  -0.833  1.00  0.00           C  
HETATM    9  C   UNL     1       5.720  -1.712   0.057  1.00  0.00           C  
HETATM   10  C   UNL     1       7.210  -1.287   0.025  1.00  0.00           C  
HETATM   11  C   UNL     1       7.124   0.259   0.050  1.00  0.00           C  
HETATM   12  N   UNL     1      -2.335   2.576  -0.088  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.992   1.283   0.153  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.152   0.522   0.018  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.193   1.407  -0.310  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.705   2.618  -0.371  1.00  0.00           N  
HETATM   17  C   UNL     1      -3.265  -0.941   0.188  1.00  0.00           C  
HETATM   18  N   UNL     1      -4.457  -1.548   0.026  1.00  0.00           N  
HETATM   19  O   UNL     1      -2.282  -1.597   0.473  1.00  0.00           O  
HETATM   20  C   UNL     1      -4.928  -2.944   0.115  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.429   3.727  -0.051  1.00  0.00           C  
HETATM   22  N   UNL     1       0.266   0.592  -0.482  1.00  0.00           N  
HETATM   23  O   UNL     1      -0.362   0.539   1.648  1.00  0.00           O  
HETATM   24  N   UNL     1       2.553   0.005  -0.999  1.00  0.00           N  
HETATM   25  N   UNL     1       3.695  -0.346  -0.269  1.00  0.00           N  
HETATM   26  H   UNL     1      -7.038  -2.915  -0.559  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.829  -2.639  -1.888  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.841  -0.321  -1.089  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.422  -0.822   0.559  1.00  0.00           H  
HETATM   30  H   UNL     1       1.510   0.111   2.064  1.00  0.00           H  
HETATM   31  H   UNL     1       4.038  -0.562   1.862  1.00  0.00           H  
HETATM   32  H   UNL     1       4.900  -1.052  -1.843  1.00  0.00           H  
HETATM   33  H   UNL     1       6.226   0.810  -1.849  1.00  0.00           H  
HETATM   34  H   UNL     1       5.358   1.433  -0.418  1.00  0.00           H  
HETATM   35  H   UNL     1       5.335  -1.674   1.076  1.00  0.00           H  
HETATM   36  H   UNL     1       5.600  -2.712  -0.360  1.00  0.00           H  
HETATM   37  H   UNL     1       7.737  -1.660   0.903  1.00  0.00           H  
HETATM   38  H   UNL     1       7.690  -1.633  -0.891  1.00  0.00           H  
HETATM   39  H   UNL     1       8.029   0.698  -0.372  1.00  0.00           H  
HETATM   40  H   UNL     1       6.965   0.615   1.068  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.223   1.133  -0.483  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.269  -3.230   1.109  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.242  -3.667  -0.325  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.067   3.937  -1.057  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.963   4.597   0.332  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.585   3.504   0.601  1.00  0.00           H  
HETATM   47  H   UNL     1       0.016   0.713  -1.412  1.00  0.00           H  
CONECT    1   20    2   26   27                                       
CONECT    2   18    1   28   29                                       
CONECT    3   13   22   23   23                                       
CONECT    4    5    6    6   30                                       
CONECT    5   22   24   24    4                                       
CONECT    6   25    4    4   31                                       
CONECT    7   25    8    9   32                                       
CONECT    8    7   11   33   34                                       
CONECT    9    7   10   35   36                                       
CONECT   10    9   11   37   38                                       
CONECT   11    8   10   39   40                                       
CONECT   12   13   16   21                                            
CONECT   13   12   14   14    3                                       
CONECT   14   13   13   15   17                                       
CONECT   15   14   16   16   41                                       
CONECT   16   12   15   15                                            
CONECT   17   14   18   19   19                                       
CONECT   18   17   20    2                                            
CONECT   19   17   17                                                 
CONECT   20   18    1   42   43                                       
CONECT   21   12   44   45   46                                       
CONECT   22    3    5   47                                            
CONECT   23    3    3                                                 
CONECT   24   25    5    5                                            
CONECT   25   24    6    7                                            
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    2                                                      
CONECT   30    4                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   15                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
