COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.316   2.309   0.058  1.00  0.00           C  
HETATM    2  C   UNL     1       3.678   1.060  -0.003  1.00  0.00           C  
HETATM    3  C   UNL     1       2.265   1.001   0.065  1.00  0.00           C  
HETATM    4  C   UNL     1       1.621  -0.254   0.003  1.00  0.00           C  
HETATM    5  C   UNL     1       1.704  -2.708  -0.187  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.865  -1.528   0.086  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.310  -0.904   1.410  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.838  -0.911   1.488  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.413  -0.102   0.324  1.00  0.00           C  
HETATM   10  C   UNL     1       1.530   2.188   0.192  1.00  0.00           C  
HETATM   11  C   UNL     1       4.426  -0.129  -0.131  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.967  -0.726  -1.000  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.439  -0.719  -1.079  1.00  0.00           C  
HETATM   14  N   UNL     1      -4.687   2.821  -1.045  1.00  0.00           N1-
HETATM   15  N   UNL     1      -4.306   2.050  -0.322  1.00  0.00           N1+
HETATM   16  N   UNL     1      -3.926   1.278   0.402  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.360  -1.521   0.008  1.00  0.00           C  
HETATM   18  O   UNL     1       0.280  -0.349   0.064  1.00  0.00           O  
HETATM   19  C   UNL     1       2.182   3.384   0.249  1.00  0.00           C  
HETATM   20  C   UNL     1       3.571   3.443   0.188  1.00  0.00           C  
HETATM   21  C   UNL     1       0.287  -2.695  -0.113  1.00  0.00           C  
HETATM   22  O   UNL     1       2.324  -3.753  -0.296  1.00  0.00           O  
HETATM   23  C   UNL     1       2.397  -1.408  -0.124  1.00  0.00           C  
HETATM   24  C   UNL     1       3.799  -1.329  -0.189  1.00  0.00           C  
HETATM   25  H   UNL     1       5.393   2.371   0.008  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.227  -2.555   0.028  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.901  -1.481   2.239  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.948   0.122   1.468  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.200  -1.938   1.430  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.156  -0.467   2.431  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.501  -0.107   0.380  1.00  0.00           H  
HETATM   32  H   UNL     1       0.451   2.155   0.245  1.00  0.00           H  
HETATM   33  H   UNL     1       5.504  -0.083  -0.183  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.329  -1.752  -1.058  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.376  -0.149  -1.829  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.077   0.308  -1.021  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.122  -1.163  -2.022  1.00  0.00           H  
HETATM   38  H   UNL     1       1.613   4.297   0.347  1.00  0.00           H  
HETATM   39  H   UNL     1       4.065   4.402   0.234  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.269  -3.621  -0.154  1.00  0.00           H  
HETATM   41  H   UNL     1       4.381  -2.233  -0.287  1.00  0.00           H  
CONECT    1   20    2    2   25                                       
CONECT    2    1    1    3   11                                       
CONECT    3   10   10    2    4                                       
CONECT    4    3   18   23   23                                       
CONECT    5   23   21   22   22                                       
CONECT    6    7   17   13   26                                       
CONECT    7    8    6   27   28                                       
CONECT    8    7    9   29   30                                       
CONECT    9    8   16   12   31                                       
CONECT   10   19    3    3   32                                       
CONECT   11    2   24   24   33                                       
CONECT   12    9   13   34   35                                       
CONECT   13   12    6   36   37                                       
CONECT   14   15   15                                                 
CONECT   15   14   14   16   16                                       
CONECT   16   15   15    9                                            
CONECT   17   18    6   21   21                                       
CONECT   18    4   17                                                 
CONECT   19   20   20   10   38                                       
CONECT   20   19   19    1   39                                       
CONECT   21   17   17    5   40                                       
CONECT   22    5    5                                                 
CONECT   23    4    4   24    5                                       
CONECT   24   11   11   23   41                                       
CONECT   25    1                                                      
CONECT   26    6                                                      
CONECT   27    7                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   24                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
