%chk=000220089.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220089

0 1
O 0.490710 -1.507232 0.078944
O -2.157649 -0.622205 -0.347472
O 3.365621 0.924261 1.277193
N 3.076959 -0.846453 -0.100138
C 0.132059 -0.179789 0.078621
C 1.195978 0.708582 0.296685
C -1.179847 0.338243 -0.137778
C 0.948434 2.096142 0.304063
C -1.402665 1.712193 -0.136543
C -0.330237 2.590739 0.085765
C 2.605694 0.282906 0.565776
C -0.552911 -2.515596 0.062675
C -3.522087 -0.159294 -0.497098
H 1.786838 2.773163 0.498157
H -2.396582 2.119709 -0.305807
H -0.510655 3.664777 0.089846
H -1.087057 -2.477078 -0.893944
H -1.237446 -2.365831 0.903900
H 0.027182 -3.438815 0.171500
H -3.616830 0.462030 -1.392399
H -3.848995 0.367343 0.404145
H -4.063933 -1.106216 -0.617719
H 2.458404 -1.491765 -0.569700
H 3.997713 -1.193513 0.122726


%chk=000220089-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220089

0 1
O 0.376221 -1.536648 -0.414738
O -2.206712 -0.578260 -0.637847
O 3.506859 1.108577 0.792447
N 2.974362 -0.987873 -0.049362
C 0.107722 -0.177018 -0.121198
C 1.180363 0.693251 0.220029
C -1.218915 0.342787 -0.245284
C 0.904139 2.066385 0.456564
C -1.470464 1.710240 0.003360
C -0.403217 2.567528 0.357441
C 2.640167 0.288159 0.350579
C -0.336648 -2.558120 0.390539
C -3.558970 -0.061885 -0.869242
H 1.753166 2.702259 0.724939
H -2.483604 2.112755 -0.086442
H -0.602257 3.627265 0.546976
H -1.420989 -2.489062 0.215235
H -0.105238 -2.424310 1.463935
H 0.052931 -3.524590 0.035784
H -3.559243 0.714087 -1.658345
H -3.999778 0.349199 0.059566
H -4.142761 -0.931957 -1.203699
H 2.238546 -1.611271 -0.400111
H 3.953013 -1.265196 0.010270


