%chk=000194341.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194341

0 1
O -2.259832 1.691594 0.499014
O 2.570043 1.661808 0.530196
O 1.297447 1.318640 -1.282631
N -0.187766 -0.711453 0.395135
N -0.153324 -3.046067 -0.167914
N 1.905533 -1.734659 -0.167646
C -2.386277 0.289200 0.091689
C -3.217023 1.361388 -0.556741
C -1.190899 -0.292159 -0.638314
C 0.593707 0.436207 0.922052
C 0.626506 -1.854872 -0.001964
C 1.468967 1.134138 -0.100937
H -2.814868 -0.344179 0.876130
H -2.955839 1.760578 -1.534923
H -4.258203 1.503701 -0.275968
H -0.755246 0.446374 -1.361368
H -1.513138 -1.163098 -1.252670
H 1.222669 0.084459 1.777994
H -0.133445 1.186170 1.337268
H -1.056858 -3.064686 0.291173
H 0.345452 -3.916616 -0.033490
H 2.483152 -2.545340 -0.356536
H 3.189742 2.118773 -0.098550


%chk=000194341-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194341

0 1
O -2.381184 1.618508 0.676308
O 2.632224 1.928695 0.463325
O 1.651439 1.057073 -1.453144
N -0.047675 -0.598625 0.212943
N -0.239256 -2.906902 -0.286317
N 1.882428 -1.923423 0.402962
C -2.403950 0.204734 0.116596
C -3.344098 1.239276 -0.421442
C -1.170167 -0.210317 -0.665098
C 0.731229 0.494682 0.795404
C 0.597894 -1.847173 0.115951
C 1.691032 1.140079 -0.207186
H -2.785460 -0.523580 0.845850
H -3.131742 1.700917 -1.394538
H -4.399116 1.219537 -0.123112
H -0.851934 0.625687 -1.318563
H -1.413719 -1.057896 -1.330678
H 1.331996 0.117819 1.636551
H 0.043376 1.277762 1.164477
H -1.235225 -2.902170 -0.075004
H 0.188839 -3.797641 -0.523136
H 2.238252 -2.894015 0.461822
H 3.235318 2.356873 -0.202973


