%chk=000239226.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239226

0 1
O -5.495353 -0.309854 -0.118524
O -2.895056 -2.894102 -0.502462
O -4.940685 3.032247 0.791862
O 6.390792 0.129384 1.612251
O 6.813679 0.753185 -0.416145
N -0.339516 -0.256195 -0.157968
N 0.657420 0.133737 -1.019715
N 2.888587 0.551083 -1.511798
N 6.050462 0.404995 0.472489
C -2.630619 -0.711344 0.416534
C -3.423223 0.495662 0.835963
C -3.555885 -1.726668 -0.215068
C -4.726510 0.635021 0.562385
C -1.567528 -0.290339 -0.584515
C -4.865352 -1.512301 -0.445648
C -5.629998 1.788082 0.915230
C 1.971482 0.161351 -0.542467
C 2.355255 -0.162276 0.786344
C 4.632139 0.313386 0.143756
C 3.694303 -0.083211 1.122712
C 4.184812 0.621820 -1.163871
H -2.146735 -1.180365 1.321169
H -2.874656 1.263507 1.382881
H -1.939938 -0.046220 -1.586804
H -5.608160 -2.164033 -0.879762
H -5.912866 1.761729 1.990470
H -6.547747 1.793016 0.293343
H 0.484128 0.375073 -2.006254
H -3.501096 -3.585372 -0.872090
H 1.599528 -0.466201 1.513645
H 4.043095 -0.322585 2.135204
H 4.899555 0.933399 -1.946024
H -4.692013 3.195588 -0.144522


%chk=000239226-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239226

0 1
O -5.563387 -0.342580 -0.242568
O -2.874609 -2.963326 -0.349835
O -5.002840 3.034898 1.141128
O 6.514626 0.068674 1.551927
O 6.892434 0.807836 -0.579319
N -0.321907 -0.275929 -0.056763
N 0.672276 0.128309 -0.927927
N 2.863859 0.586645 -1.505224
N 6.108100 0.400000 0.367081
C -2.681950 -0.684429 0.458596
C -3.541312 0.527667 0.809391
C -3.568481 -1.755763 -0.149620
C -4.847018 0.655210 0.455548
C -1.556762 -0.289201 -0.491079
C -4.876146 -1.563694 -0.468518
C -5.746735 1.842757 0.741202
C 1.999032 0.162761 -0.524946
C 2.412914 -0.208654 0.789835
C 4.674218 0.307515 0.082718
C 3.776803 -0.131861 1.090755
C 4.180479 0.655419 -1.198231
H -2.194383 -1.089630 1.367938
H -3.083672 1.332806 1.390371
H -1.848695 0.006033 -1.518326
H -5.537814 -2.311190 -0.912704
H -6.411841 1.625357 1.594332
H -6.386136 2.023406 -0.148875
H 0.483896 0.406988 -1.903145
H -3.469225 -3.675738 -0.696406
H 1.670087 -0.540046 1.517030
H 4.166746 -0.400365 2.076038
H 4.864959 0.992697 -1.981452
H -4.395215 3.298628 0.403649


