%chk=000250472.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250472

0 1
O 0.498824 -0.300469 0.024441
O -0.452130 0.659562 -1.856177
N 1.767861 -0.085850 -0.547786
C -1.816464 -0.173856 0.031944
C -2.563615 1.137573 0.338266
C -2.696561 -1.149440 -0.771469
C -3.875672 0.848328 1.078644
C -4.008070 -1.428547 -0.026233
C -4.759041 -0.127378 0.288779
C -0.572050 0.149231 -0.782284
C 4.132597 -0.397715 -0.241107
C 5.019239 0.196483 0.862487
C 2.708089 -0.532325 0.225990
C 6.468193 0.323677 0.401523
H -1.518882 -0.659380 0.997120
H -2.774428 1.678911 -0.607010
H -1.924366 1.808508 0.942591
H -2.151394 -2.095114 -0.951577
H -2.913923 -0.721712 -1.771901
H -3.659426 0.432103 2.081465
H -4.421161 1.795445 1.251957
H -4.647383 -2.094984 -0.635960
H -3.799656 -1.978739 0.911586
H -5.678815 -0.351293 0.860424
H -5.092043 0.349366 -0.653761
H 4.504519 -1.399877 -0.543907
H 4.196761 0.228746 -1.158873
H 4.630000 1.192431 1.156573
H 4.969196 -0.432037 1.773318
H 2.560953 -1.013163 1.203871
H 6.897085 -0.648306 0.131823
H 6.558675 0.976110 -0.475521
H 7.097586 0.751413 1.190864


%chk=000250472-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250472

0 1
O 0.537700 -0.437427 0.038984
O -0.485554 0.543825 -1.857306
N 1.868220 -0.172860 -0.616011
C -1.854423 -0.273491 0.029199
C -2.530808 1.073615 0.424042
C -2.817637 -1.133898 -0.837605
C -3.871829 0.828052 1.153743
C -4.159360 -1.371966 -0.106780
C -4.829151 -0.038457 0.301858
C -0.569902 0.008162 -0.740778
C 4.244903 -0.482773 -0.223903
C 5.058308 0.342022 0.812078
C 2.798792 -0.631546 0.179272
C 6.550443 0.434132 0.428501
H -1.598577 -0.828985 0.951707
H -2.704663 1.662612 -0.497942
H -1.847680 1.663689 1.064852
H -2.339279 -2.101087 -1.085066
H -2.995520 -0.605171 -1.794190
H -3.677254 0.317567 2.119757
H -4.345410 1.799304 1.395218
H -4.837078 -1.956686 -0.758498
H -3.981507 -1.985350 0.801008
H -5.764636 -0.236257 0.860089
H -5.111545 0.522591 -0.612611
H 4.696641 -1.492627 -0.310782
H 4.300360 -0.007842 -1.219982
H 4.623870 1.357231 0.885361
H 4.957950 -0.119759 1.814906
H 2.564396 -1.112008 1.144667
H 7.011475 -0.570236 0.377191
H 6.677651 0.914336 -0.559408
H 7.115604 1.028989 1.168528


