%chk=000180344.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180344

0 1
O -2.539630 0.863597 0.332210
O 2.117145 -1.131041 0.879856
O -1.166882 1.951334 -1.101245
O 2.907311 0.799721 0.069202
N -0.403647 0.059940 0.076231
N -1.435282 -2.114975 -0.270905
C 0.782823 -0.095406 -0.801388
C -0.889817 -1.187532 0.746875
C -1.339391 1.022421 -0.341966
C 2.031498 -0.025722 0.057953
H 0.825760 0.730212 -1.562997
H 0.755933 -1.063236 -1.363557
H -1.635821 -0.869140 1.518514
H -0.004217 -1.642984 1.264392
H -1.234107 -3.085289 -0.064987
H -2.433826 -2.001683 -0.405691
H -3.151067 1.629556 0.142738
H 2.927416 -1.113872 1.457866


%chk=000180344-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180344

0 1
O -2.295064 1.155013 0.786938
O 1.723159 -0.151318 1.252962
O -0.651176 2.202590 -0.507808
O 3.059372 -0.033291 -0.643723
N -0.607374 -0.120144 -0.154040
N -1.216093 -2.480063 -0.341467
C 0.622938 -0.267714 -0.923440
C -1.158921 -1.332405 0.540009
C -1.122386 1.146177 -0.005497
C 1.923968 -0.126918 -0.133682
H 0.659651 0.477597 -1.734967
H 0.605135 -1.276293 -1.381050
H -2.139357 -1.026002 0.938444
H -0.494205 -1.568593 1.391891
H -0.752514 -3.337188 -0.052394
H -2.036095 -2.594755 -0.933980
H -2.608057 2.095029 0.826690
H 2.601219 -0.035820 1.708216


