%chk=000238601.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238601

0 1
O 4.416431 -1.679213 0.309735
O 2.345566 -2.614449 0.196664
N -1.418749 2.520709 -0.216325
N 3.146451 -1.602268 0.042254
N -2.776567 2.708868 -0.246293
C 0.537934 1.140038 -0.049373
C -0.932753 1.279981 -0.123326
C -1.819317 0.065125 -0.085337
C 1.134150 -0.147663 -0.029367
C 1.390541 2.286606 0.000284
C 2.537963 -0.248458 0.029177
C -2.015600 -0.645401 1.129138
C -2.502394 -0.371880 -1.252657
C 2.790973 2.150068 0.055244
C 3.393504 0.871574 0.072800
C -2.869526 -1.769454 1.174364
C -3.356267 -1.497809 -1.208194
C -3.542637 -2.198490 0.006111
H 0.532516 -1.059821 -0.062820
H 0.920785 3.274142 -0.006930
H -1.490986 -0.316629 2.033917
H -2.343032 0.158311 -2.199816
H 3.421826 3.044304 0.096619
H 4.475262 0.728342 0.123065
H -3.005898 -2.311542 2.116805
H -3.863835 -1.831842 -2.120023
H -4.198184 -3.075926 0.040399
H -3.073738 3.660294 -0.432736
H -3.436617 1.925879 -0.301879


%chk=000238601-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238601

0 1
O 4.455850 -1.676285 0.194250
O 2.393636 -2.627567 0.006588
N -1.403338 2.498319 -0.369702
N 3.169781 -1.598278 0.094435
N -2.742661 2.716013 -0.474576
C 0.536167 1.127310 -0.051554
C -0.934745 1.263598 -0.184733
C -1.828196 0.057404 -0.101253
C 1.148273 -0.153035 -0.037502
C 1.375269 2.278873 0.055163
C 2.550076 -0.248648 0.081497
C -1.940203 -0.681800 1.107124
C -2.599085 -0.349343 -1.225053
C 2.773131 2.154110 0.168578
C 3.387097 0.881740 0.185376
C -2.799520 -1.799763 1.190155
C -3.457089 -1.469442 -1.142368
C -3.561020 -2.196574 0.066143
H 0.560414 -1.069992 -0.126573
H 0.900238 3.263877 0.043228
H -1.350959 -0.377859 1.979828
H -2.503404 0.197427 -2.170544
H 3.392775 3.053361 0.248904
H 4.468256 0.752423 0.275748
H -2.870722 -2.362373 2.127418
H -4.034197 -1.778806 -2.020815
H -4.222340 -3.067641 0.129484
H -3.024224 3.685741 -0.571914
H -3.441458 1.970608 -0.385833


