%chk=000058454.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058454

0 1
 O   0.5152000     -0.6844000     -0.3473000    
 O    1.026300       1.316300      0.6994000    
 N    2.737500     -8.9699998E-02 -1.0900000E-02
 N   -1.234400      0.7761000     -0.7853000    
 C    3.799800      0.7884000      0.4584000    
 C    3.166900      -1.330800     -0.6472000    
 C    1.397200      0.2735000      0.1617000    
 C  -0.8362000     -0.3576000     -0.1937000    
 C   -1.625300      -1.210300      0.5363000    
 C   -2.964700     -0.8637000      0.6744000    
 C   -3.440000      0.3019000      8.3499998E-02
 C   -2.542300       1.080200     -0.6293000    
 H    4.402400      0.2493000       1.195200    
 H    3.400500       1.694800      0.9204000    
 H    4.426400       1.069400     -0.3930000    
 H    3.761800      -1.902900      7.0900001E-02
 H    3.784700      -1.082000      -1.515000    
 H    2.327600      -1.945600     -0.9773000    
 H   -1.233800      -2.113900      0.9885000    
 H   -3.636900      -1.500500       1.241400    
 H   -4.480200      0.5919000      0.1782000    
 H   -2.862900       1.999200      -1.109000    


%chk=000058454-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000058454

0 1
O 0.564357 -0.770174 0.254047
O 1.247700 1.261748 1.263770
N 2.760603 -0.064375 0.046126
N -1.091027 0.657805 -0.646990
C 3.908142 0.799319 0.368769
C 3.021825 -1.219028 -0.826424
C 1.528354 0.266409 0.560469
C -0.791359 -0.394736 0.144570
C -1.745874 -1.197956 0.808186
C -3.106701 -0.870516 0.629200
C -3.451373 0.236596 -0.184062
C -2.410953 0.969761 -0.797077
H 4.698855 0.216296 0.878627
H 3.569715 1.610838 1.029686
H 4.331699 1.238526 -0.554686
H 3.728805 -1.919282 -0.340105
H 3.468358 -0.878693 -1.780779
H 2.083278 -1.747132 -1.036174
H -1.419946 -2.030503 1.436277
H -3.883331 -1.463460 1.123332
H -4.494921 0.525406 -0.339790
H -2.626607 1.832749 -1.436673


