%chk=000047410.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047410

0 1
 O  -0.6403000      -1.588500     -0.7338000    
 O    3.325500     -0.2295000     -0.6188000    
 O    1.875700       1.498600     -0.3424000    
 N   0.1219000     -0.1714000      0.9496000    
 C   -2.212900     -0.2120000      0.3462000    
 C   -2.435800       1.259000      0.2624000    
 C   -2.953100      0.3538000     -0.8170000    
 C  -0.8323000     -0.7342000      0.1238000    
 C    1.520300     -0.5341000      0.9033000    
 C    2.231000      0.3584000     -7.3299997E-02
 H   -2.798600     -0.7682000       1.070600    
 H   -1.609800       1.912000      8.2000000E-03
 H   -3.157700       1.699900      0.9393000    
 H   -4.022600      0.1887000     -0.8658000    
 H   -2.464100      0.3952000      -1.782700    
 H  -0.1593000      0.5338000       1.624600    
 H    1.609000      -1.577800      0.5869000    
 H    1.950900     -0.4021000       1.899000    
 H    3.784700      0.3655000      -1.249200    


%chk=000047410-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000047410

0 1
O -0.896408 -0.801168 -1.322812
O 3.946323 -0.425397 0.326278
O 2.615199 0.805617 1.784016
N 0.337828 0.184167 0.372744
C -2.075576 0.552904 0.331326
C -3.197983 0.996327 -0.636619
C -3.402041 -0.236660 0.231562
C -0.856853 -0.074960 -0.277212
C 1.591876 -0.369343 -0.125860
C 2.728526 0.078574 0.771095
H -1.921083 1.159502 1.229974
H -2.997465 0.829025 -1.698223
H -3.737895 1.915038 -0.391834
H -4.084161 -0.178591 1.084127
H -3.337494 -1.209838 -0.262324
H 0.385360 0.765888 1.213992
H 1.792473 -0.047311 -1.166334
H 1.562860 -1.476030 -0.160235
H 4.679015 -0.120643 0.927237


