%chk=000230976.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230976

0 1
O -2.932997 -0.555811 0.000051
O -1.993481 -2.616196 0.000025
O -3.330613 1.673241 0.000207
O 3.893129 0.791828 -0.001113
O 3.433927 -1.326471 0.002346
N 3.123258 -0.150732 0.000469
C -0.594945 -0.570796 -0.000108
C -1.015472 0.784739 0.000006
C 0.742193 -0.908237 0.000035
C -0.112866 1.826938 0.000253
C 1.665889 0.165873 0.000294
C 1.262254 1.501869 0.000345
C -1.807092 -1.443176 -0.000372
C -2.517404 0.806122 -0.000209
H 1.091589 -1.949508 -0.000119
H -0.439418 2.870624 0.000364
H 2.016950 2.301693 0.000428


%chk=000230976-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230976

0 1
O -2.981411 -0.569848 0.000097
O -1.928489 -2.679402 0.000351
O -3.317424 1.762721 -0.000089
O 3.939100 0.842142 0.000657
O 3.463606 -1.390056 0.000601
N 3.117791 -0.149943 0.000354
C -0.615683 -0.569957 0.000071
C -1.037953 0.778526 -0.000006
C 0.742381 -0.919468 0.000220
C -0.118880 1.841633 0.000014
C 1.654962 0.159554 0.000231
C 1.257008 1.518422 0.000138
C -1.818843 -1.452387 -0.000084
C -2.530924 0.812848 -0.000035
H 1.090839 -1.955435 0.000253
H -0.460395 2.880459 -0.000048
H 2.029216 2.292193 0.000176


