%chk=000271853.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271853

0 1
O 3.309624 0.115474 -1.559900
O 2.349936 0.059590 1.937130
O 5.500492 -0.104153 -0.047758
O 6.059793 -2.909142 0.018776
O 2.670362 3.450450 0.217240
O -6.834784 -0.624580 -0.279243
O -5.909778 -2.289405 0.746206
N 0.294935 0.784178 0.151346
N -0.835194 1.342168 -0.371148
N -5.865285 -1.205907 0.184367
C 3.111913 -0.524352 -0.282655
C 2.639639 0.614252 0.664052
C 4.479904 -1.075117 0.177957
C 1.457256 1.358822 0.051993
C 4.870563 -2.370508 -0.559774
C 1.837062 2.656625 -0.626551
C -2.067364 0.672545 -0.192543
C -3.221881 1.308875 -0.714862
C -2.169398 -0.579601 0.456383
C -4.555238 -0.556194 0.055333
C -4.458161 0.691021 -0.588626
C -3.409836 -1.187782 0.577933
H 2.342719 -1.318754 -0.366447
H 3.482682 1.328971 0.883330
H 4.508019 -1.224280 1.288129
H 5.046940 -2.194907 -1.635988
H 4.130637 -3.180770 -0.424048
H 2.498259 2.444309 -1.502350
H 0.971232 3.257624 -0.953368
H 3.215220 -0.537384 -2.283977
H 1.501726 -0.441737 1.937328
H 5.346972 0.361071 -0.911036
H -0.829327 2.262179 -0.822749
H 6.741164 -2.194491 0.093600
H 2.209549 3.666453 1.058837
H -3.152405 2.273535 -1.213393
H -1.277747 -1.061779 0.859280
H -5.365089 1.164306 -0.985662
H -3.512811 -2.159105 1.078055


%chk=000271853-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271853

0 1
O 3.699376 0.296888 -1.600154
O 2.114088 -0.458944 1.677737
O 5.637380 -0.104604 0.308052
O 6.468220 -2.707053 -0.102685
O 2.346444 3.477699 0.263242
O -7.048343 -0.355591 -0.157235
O -6.159386 -2.057952 1.080712
N 0.268909 0.654208 0.127575
N -0.866339 1.229964 -0.392290
N -6.045790 -0.974266 0.381370
C 3.318118 -0.528720 -0.421592
C 2.598286 0.399634 0.598625
C 4.591448 -1.143049 0.200874
C 1.461426 1.193474 -0.039612
C 5.156526 -2.328413 -0.611067
C 1.804801 2.509632 -0.711410
C -2.129245 0.659345 -0.182448
C -3.264417 1.303670 -0.755734
C -2.300131 -0.531629 0.578914
C -4.700433 -0.412557 0.186951
C -4.547784 0.771124 -0.572826
C -3.584187 -1.064769 0.761941
H 2.607774 -1.326554 -0.720872
H 3.335899 1.099117 1.031844
H 4.379765 -1.461227 1.234766
H 5.220037 -2.060587 -1.695169
H 4.509370 -3.216989 -0.506982
H 2.628320 2.343203 -1.421538
H 0.950310 2.952970 -1.266986
H 3.918713 -0.298194 -2.360951
H 1.137971 -0.585419 1.510086
H 5.534909 0.482797 -0.491702
H -0.809964 2.083633 -0.960404
H 6.925369 -1.854595 0.137579
H 1.692805 3.615246 0.996399
H -3.136234 2.221054 -1.343018
H -1.426625 -1.020852 1.013205
H -5.432261 1.248282 -1.002372
H -3.742822 -1.977476 1.342377


