COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.754  -3.747  13.109  1.00  0.00           C  
HETATM    2  C   UNL     1       1.957  -4.512  12.258  1.00  0.00           C  
HETATM    3  C   UNL     1       1.823  -4.152  10.917  1.00  0.00           C  
HETATM    4  C   UNL     1       2.486  -3.026  10.428  1.00  0.00           C  
HETATM    5  C   UNL     1       3.282  -2.260  11.279  1.00  0.00           C  
HETATM    6  C   UNL     1       3.416  -2.621  12.620  1.00  0.00           C  
HETATM    7  C   UNL     1       2.348  -2.653   9.037  1.00  0.00           C  
HETATM    8  C   UNL     1       2.128  -3.635   8.071  1.00  0.00           C  
HETATM    9  C   UNL     1       1.995  -3.276   6.729  1.00  0.00           C  
HETATM   10  C   UNL     1       2.082  -1.935   6.355  1.00  0.00           C  
HETATM   11  C   UNL     1       2.301  -0.953   7.321  1.00  0.00           C  
HETATM   12  C   UNL     1       2.434  -1.312   8.662  1.00  0.00           C  
HETATM   13  C   UNL     1       1.945  -1.563   4.967  1.00  0.00           C  
HETATM   14  C   UNL     1       4.245  -1.822  13.510  1.00  0.00           C  
HETATM   15  N   UNL     1       4.852  -0.768  13.006  1.00  0.00           N  
HETATM   16  N   UNL     1       4.441  -2.095  14.859  1.00  0.00           N  
HETATM   17  N   UNL     1       1.177  -2.286   4.097  1.00  0.00           N  
HETATM   18  C   UNL     1       1.254  -1.680   2.869  1.00  0.00           C  
HETATM   19  C   UNL     1       2.093  -0.588   3.073  1.00  0.00           C  
HETATM   20  N   UNL     1       2.512  -0.532   4.383  1.00  0.00           N  
HETATM   21  C   UNL     1       2.387   0.261   1.993  1.00  0.00           C  
HETATM   22  C   UNL     1       0.679  -1.985   1.634  1.00  0.00           C  
HETATM   23  C   UNL     1       0.983  -1.129   0.570  1.00  0.00           C  
HETATM   24  C   UNL     1       1.821  -0.025   0.744  1.00  0.00           C  
HETATM   25  C   UNL     1       2.113   0.841  -0.387  1.00  0.00           C  
HETATM   26  N   UNL     1       1.610   0.656  -1.670  1.00  0.00           N  
HETATM   27  N   UNL     1       2.907   1.871  -0.186  1.00  0.00           N  
HETATM   28  H   UNL     1       2.850  -4.036  14.153  1.00  0.00           H  
HETATM   29  H   UNL     1       1.442  -5.389  12.638  1.00  0.00           H  
HETATM   30  H   UNL     1       1.200  -4.759  10.265  1.00  0.00           H  
HETATM   31  H   UNL     1       3.801  -1.382  10.902  1.00  0.00           H  
HETATM   32  H   UNL     1       2.059  -4.684   8.347  1.00  0.00           H  
HETATM   33  H   UNL     1       1.825  -4.052   5.987  1.00  0.00           H  
HETATM   34  H   UNL     1       2.371   0.096   7.044  1.00  0.00           H  
HETATM   35  H   UNL     1       2.605  -0.536   9.404  1.00  0.00           H  
HETATM   36  H   UNL     1       4.623  -0.683  12.009  1.00  0.00           H  
HETATM   37  H   UNL     1       5.033  -1.509  15.438  1.00  0.00           H  
HETATM   38  H   UNL     1       3.996  -2.880  15.321  1.00  0.00           H  
HETATM   39  H   UNL     1       0.645  -3.118   4.315  1.00  0.00           H  
HETATM   40  H   UNL     1       3.039   1.118   2.130  1.00  0.00           H  
HETATM   41  H   UNL     1       0.029  -2.842   1.501  1.00  0.00           H  
HETATM   42  H   UNL     1       0.551  -1.336  -0.407  1.00  0.00           H  
HETATM   43  H   UNL     1       1.841   1.291  -2.427  1.00  0.00           H  
HETATM   44  H   UNL     1       1.005  -0.122  -1.905  1.00  0.00           H  
HETATM   45  H   UNL     1       3.204   1.890   0.796  1.00  0.00           H  
CONECT    1    2    2    6   28                                       
CONECT    2    1    1    3   29                                       
CONECT    3    2    4    4   30                                       
CONECT    4    3    3    7    5                                       
CONECT    5    4    6    6   31                                       
CONECT    6    1    5    5   14                                       
CONECT    7    4    8    8   12                                       
CONECT    8    7    7    9   32                                       
CONECT    9    8   10   10   33                                       
CONECT   10    9    9   13   11                                       
CONECT   11   10   12   12   34                                       
CONECT   12    7   11   11   35                                       
CONECT   13   10   20   20   17                                       
CONECT   14    6   16   15   15                                       
CONECT   15   14   14   36                                            
CONECT   16   14   37   38                                            
CONECT   17   13   18   39                                            
CONECT   18   17   22   22   19                                       
CONECT   19   18   21   21   20                                       
CONECT   20   13   13   19                                            
CONECT   21   19   19   24   40                                       
CONECT   22   18   18   23   41                                       
CONECT   23   22   24   24   42                                       
CONECT   24   21   23   23   25                                       
CONECT   25   24   26   27   27                                       
CONECT   26   25   43   44                                            
CONECT   27   25   25   45                                            
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   26                                                      
CONECT   44   26                                                      
CONECT   45   27                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
