%chk=000245058.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245058

0 1
O -1.813134 -2.763626 0.394266
O -3.762716 -0.590825 0.398785
O -0.968140 3.436394 -0.128426
O 1.097321 2.822427 -0.180020
N 1.752460 0.298898 -0.044941
N -0.110072 2.565008 -0.099996
C 4.167601 -0.213149 -0.157820
C 2.754710 -0.798208 -0.028932
C 5.221004 -1.329522 -0.143735
C 0.405909 0.088119 0.049678
C -0.517601 1.191973 0.025598
C -0.123475 -1.229861 0.174423
C 6.632699 -0.763887 -0.271170
C -1.491052 -1.450256 0.263968
C -1.912793 0.942042 0.131290
C -2.403984 -0.338105 0.228438
C -3.210429 -3.137186 0.557739
C -4.593999 -0.131890 -0.701366
H 4.367358 0.500901 0.667157
H 4.258502 0.376288 -1.092968
H 2.659648 -1.377431 0.919727
H 2.549040 -1.504385 -0.867480
H 5.029438 -2.042635 -0.970237
H 5.138441 -1.917369 0.792249
H 2.115344 1.268028 -0.127306
H 0.538571 -2.092526 0.208968
H 6.873474 -0.081389 0.552627
H 7.382051 -1.564240 -0.260636
H 6.764818 -0.206063 -1.205891
H -2.598276 1.800753 0.128655
H -3.128560 -4.213932 0.745992
H -3.758728 -2.920298 -0.362940
H -3.649384 -2.603196 1.409285
H -5.583901 -0.499802 -0.408223
H -4.262480 -0.574322 -1.643509
H -4.584564 0.960572 -0.750352


%chk=000245058-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245058

0 1
O -1.790709 -2.905362 0.277195
O -3.806307 -0.794168 -0.028857
O -1.069096 3.380107 -0.570527
O 1.131482 2.766744 -0.493427
N 1.771872 0.241201 -0.157484
N -0.155234 2.463936 -0.448729
C 4.201328 -0.216218 -0.135506
C 2.784430 -0.810394 -0.017618
C 5.300836 -1.290312 0.019968
C 0.417226 0.021712 -0.120573
C -0.546030 1.090816 -0.262103
C -0.114952 -1.288747 0.065109
C 6.723191 -0.703468 -0.102915
C -1.491833 -1.559099 0.104409
C -1.941342 0.820622 -0.225510
C -2.434862 -0.472919 -0.051351
C -3.158152 -3.411733 0.510786
C -4.747303 0.315663 -0.206502
H 4.336814 0.565999 0.638522
H 4.309079 0.283726 -1.118999
H 2.676058 -1.319812 0.964441
H 2.641072 -1.586526 -0.799965
H 5.157354 -2.076625 -0.748908
H 5.189478 -1.789759 1.003832
H 2.041538 1.230515 -0.290747
H 0.553338 -2.143587 0.187507
H 6.905775 0.061809 0.674464
H 7.493062 -1.488429 0.008071
H 6.869997 -0.222416 -1.088029
H -2.602576 1.681274 -0.348033
H -3.011099 -4.488615 0.685471
H -3.798621 -3.242042 -0.368469
H -3.612383 -2.934183 1.394235
H -5.745455 -0.143916 -0.161594
H -4.602232 0.807510 -1.187523
H -4.640642 1.063995 0.602254


