%chk=000229859.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229859

0 1
O -0.517465 -1.454647 1.042393
O -1.322590 1.042094 1.635325
O 2.059595 -1.003906 0.821854
O 3.123192 0.304863 -0.987759
N -2.907526 0.162572 -1.626400
C -0.151117 -0.425327 0.110467
C -1.259763 0.643284 0.265532
C 1.239820 0.125204 0.506806
C -2.643910 0.108893 -0.173421
C 1.910479 0.961630 -0.602268
H -0.146275 -0.885371 -0.900538
H -0.993414 1.587724 -0.258525
H 1.177209 0.671936 1.479739
H -2.772836 -0.943337 0.176176
H -3.431099 0.699208 0.353205
H 1.332667 0.992343 -1.544706
H 2.122601 1.993839 -0.274769
H 0.303916 -1.908909 1.380880
H -1.418952 0.235757 2.207876
H 2.435179 -1.398035 -0.014794
H -2.258495 -0.421164 -2.142127
H -2.826777 1.108737 -1.982953
H 3.783359 0.364912 -0.254993


%chk=000229859-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229859

0 1
O -0.529439 -1.486263 1.143923
O -1.514384 0.952831 1.776158
O 2.086034 -0.976489 1.104449
O 2.391223 0.040004 -1.361917
N -2.552893 0.029030 -1.782864
C -0.143532 -0.381153 0.246718
C -1.285968 0.652128 0.355530
C 1.226179 0.168192 0.724955
C -2.599705 0.153311 -0.322071
C 1.950371 1.009607 -0.332092
H -0.050219 -0.748682 -0.796838
H -0.982889 1.611764 -0.106588
H 1.073229 0.751057 1.649527
H -2.862506 -0.830084 0.109135
H -3.401729 0.858574 -0.036507
H 1.269417 1.766397 -0.768052
H 2.823385 1.515299 0.124713
H 0.332526 -1.899272 1.435900
H -1.511807 0.062631 2.226593
H 2.539229 -1.260210 0.261639
H -2.047005 -0.771289 -2.162938
H -2.434101 0.891779 -2.315418
H 3.062383 0.453137 -1.956954


