%chk=000198044.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198044

0 1
O -0.473134 0.974996 1.219208
O -3.580826 1.138666 -0.631611
N -1.299050 -1.705449 -0.298743
C -2.517468 0.413524 0.016958
C -1.579780 1.543634 0.476798
C -1.885306 -0.556069 -1.005468
C 0.908673 -0.586870 -0.022296
C 0.669496 0.709762 0.462104
C -0.086081 -1.686939 0.145805
C 2.123104 -0.828290 -0.683027
C 1.599584 1.747192 0.300641
C 0.411005 -2.881532 0.906334
C 3.058126 0.194894 -0.853324
C 2.799078 1.479553 -0.358183
H -2.928701 -0.142488 0.890383
H -1.231752 2.167344 -0.361829
H -2.070692 2.182815 1.236374
H -2.682587 -0.965712 -1.670177
H -1.179287 -0.020733 -1.675951
H 2.333825 -1.824987 -1.072717
H 1.379400 2.734604 0.701585
H 0.748092 -2.585775 1.910767
H 1.253793 -3.365397 0.397303
H -0.376113 -3.642207 1.035416
H 3.994120 -0.007069 -1.371603
H -4.357339 0.559480 -0.762226
H 3.536119 2.271950 -0.488422


%chk=000198044-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198044

0 1
O -0.473430 0.945261 1.248650
O -3.595767 1.243059 -0.722959
N -1.310969 -1.695914 -0.203242
C -2.578664 0.457206 -0.000159
C -1.651666 1.539100 0.578357
C -1.850111 -0.535591 -0.950012
C 0.937629 -0.613615 -0.021126
C 0.672828 0.703048 0.451066
C -0.061949 -1.721711 0.188787
C 2.168935 -0.851364 -0.686229
C 1.599941 1.749932 0.245473
C 0.426856 -2.947055 0.936918
C 3.092652 0.192695 -0.908881
C 2.806244 1.497700 -0.442961
H -3.037571 -0.130425 0.821688
H -1.339064 2.225734 -0.232971
H -2.176933 2.109923 1.360052
H -2.607800 -0.937470 -1.649847
H -1.094236 0.017032 -1.549198
H 2.392304 -1.859973 -1.052735
H 1.372982 2.743182 0.647436
H 0.748202 -2.670728 1.958936
H 1.305003 -3.401271 0.439366
H -0.381672 -3.692109 0.995334
H 4.030181 -0.009831 -1.437469
H -4.351344 0.652099 -0.967485
H 3.523719 2.309982 -0.602690


