%chk=000130818.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000130818

0 1
O -4.184601 0.952947 0.328998
O 0.628392 3.333545 1.205109
O 0.485076 3.426043 -0.957994
O -2.667748 -3.727178 0.028921
O 4.159698 -0.679537 -0.285066
O 3.146363 -2.595484 -0.300840
N -1.817203 1.326602 0.190624
N -1.792784 -1.495458 0.068062
N 0.551901 2.842912 0.100915
N 3.165020 -1.378841 -0.250072
C -0.627944 0.610744 0.082332
C -0.553553 -0.825619 0.015944
C 0.577104 1.343244 0.035140
C 1.854712 -0.688617 -0.135114
C 0.683185 -1.462391 -0.091928
C 1.816355 0.707274 -0.072800
C -3.024865 0.979379 0.254487
C -2.109138 -2.704444 0.036490
H 0.762698 -2.556868 -0.144003
H 2.752233 1.286447 -0.108905


%chk=000130818-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130818

0 1
O -4.292169 1.139443 0.217517
O 1.615857 3.396263 0.515164
O -0.524825 3.419555 -0.274857
O -2.939719 -3.697660 -0.041319
O 4.278481 -0.580960 -0.162878
O 3.263254 -2.626851 -0.228649
N -1.864897 1.134061 0.149730
N -1.692761 -1.610332 -0.001918
N 0.542485 2.809690 0.103397
N 3.236820 -1.338272 -0.165310
C -0.632775 0.556452 0.050262
C -0.513837 -0.881460 -0.016951
C 0.572021 1.321029 0.046128
C 1.904928 -0.683231 -0.088900
C 0.753240 -1.493787 -0.093939
C 1.838978 0.716732 -0.010701
C -3.084407 1.065269 0.175592
C -2.260710 -2.695442 -0.024964
H 0.858508 -2.580743 -0.152327
H 2.746429 1.324945 0.005223


