%chk=000221998.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221998

0 1
O -0.689344 -1.206153 -0.134969
O -0.727628 1.100601 0.117457
O -3.559043 -1.384291 1.550064
O -3.513627 0.755147 1.850406
N -3.336525 -0.245643 1.183524
C -2.871771 -0.059360 -0.279727
C -2.003657 -1.271973 -0.696396
C -2.051080 1.242383 -0.411137
C 0.029794 0.006703 -0.429094
C -4.153596 -0.012464 -1.141597
C 1.299753 -0.064774 0.407937
C 2.562992 0.045203 -0.448612
C 3.826105 -0.029356 0.420317
C -5.022928 1.212662 -0.890149
C 5.097545 0.079653 -0.431496
C 6.361687 0.005814 0.436630
C 7.631431 0.113191 -0.404745
H -2.390463 -2.227194 -0.276215
H -1.928963 -1.344441 -1.795670
H -1.993065 1.563362 -1.465861
H -2.464526 2.061646 0.218327
H 0.142376 0.127439 -1.520954
H -4.747800 -0.936105 -0.963844
H -3.868404 -0.049041 -2.213661
H 1.294942 -1.015197 0.988471
H 1.269490 0.740568 1.176632
H 2.580904 -0.765230 -1.203887
H 2.555293 0.997192 -1.015385
H 3.835340 -0.978289 0.991462
H 3.810174 0.777739 1.178677
H -5.227703 1.370811 0.179490
H -4.564511 2.134486 -1.266831
H -5.996758 1.110713 -1.386970
H 5.091069 1.028024 -1.002420
H 5.116597 -0.727413 -1.188919
H 6.346060 0.813937 1.194128
H 6.371291 -0.943193 1.007950
H 8.527779 0.059576 0.223466
H 7.673087 1.060268 -0.954561
H 7.698382 -0.696201 -1.140540


%chk=000221998-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221998

0 1
O -0.331627 -0.635050 -0.436809
O -1.010020 1.429676 0.594731
O -3.171300 -2.128957 0.757014
O -3.379215 -0.204214 1.948644
N -3.107228 -0.849705 0.875026
C -2.763844 -0.043580 -0.421456
C -1.603140 -0.766767 -1.151047
C -2.331500 1.390663 -0.044443
C 0.006867 0.779593 -0.234111
C -4.047411 -0.072886 -1.301885
C 1.338283 0.858997 0.496472
C 2.511874 0.276697 -0.321642
C 3.857608 0.370609 0.431065
C -5.300016 0.569437 -0.667397
C 5.039533 -0.229502 -0.362796
C 6.389389 -0.131234 0.383966
C 7.563404 -0.745520 -0.408637
H -1.802716 -1.845711 -1.223850
H -1.520823 -0.325182 -2.169332
H -2.322326 1.992019 -0.981165
H -3.018967 1.841917 0.683316
H 0.025417 1.278335 -1.236807
H -4.256849 -1.128378 -1.560365
H -3.802803 0.448038 -2.248232
H 1.228255 0.316249 1.453642
H 1.525022 1.921933 0.740508
H 2.291496 -0.779782 -0.566082
H 2.596982 0.815664 -1.289171
H 3.768768 -0.153101 1.405668
H 4.076059 1.433250 0.668048
H -5.584724 0.071205 0.275621
H -5.151484 1.642611 -0.453228
H -6.153768 0.483687 -1.362364
H 5.125731 0.286255 -1.342470
H 4.824882 -1.294516 -0.590670
H 6.607032 0.933901 0.604661
H 6.299244 -0.639149 1.366011
H 8.515449 -0.663839 0.147581
H 7.695567 -0.235259 -1.381634
H 7.383598 -1.817605 -0.615086


