%chk=000266677.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266677

0 1
O -2.645211 0.423197 -2.080411
O -1.665408 0.291476 1.597232
O -3.359193 -2.173483 -0.143872
O -4.451271 0.998645 -0.752015
O -0.813896 -1.363363 2.883074
O -4.591012 -2.333501 1.750999
O 3.486799 2.243394 2.313179
O 1.364706 1.906965 2.133398
O 5.942996 -0.443310 -2.652851
O 6.619994 0.693443 -0.939628
N 0.369904 0.711846 0.044617
N 2.523902 1.801788 1.715429
N 5.748846 0.173850 -1.617306
C -0.791324 0.096879 -0.635263
C -1.678361 -0.587845 0.438424
C -1.600352 1.176332 -1.412309
C -3.163065 -0.749939 0.074575
C -3.661071 -0.090873 -1.229648
C -0.829491 1.829539 -2.541230
C 1.667220 0.549069 -0.325519
C -1.163238 -0.214295 2.806986
C 2.738535 1.113930 0.456756
C -4.097355 -2.887244 0.804255
C 2.017248 -0.173195 -1.521919
C -5.180394 1.711243 -1.775163
C 4.072882 0.983646 0.015703
C -1.146517 0.889527 3.790521
C 3.317997 -0.293452 -1.926402
C -4.114961 -4.312726 0.393294
C 4.362985 0.300872 -1.157158
H -0.466530 -0.692500 -1.370894
H -1.248088 -1.584996 0.723784
H -2.066610 1.913919 -0.720778
H -3.800451 -0.398808 0.939523
H -4.223664 -0.776072 -1.898660
H 0.129123 1.263713 0.903153
H -0.508812 1.098811 -3.296248
H -1.461411 2.558360 -3.070128
H 0.058343 2.361310 -2.179348
H 1.215562 -0.627343 -2.109737
H -4.499724 2.041965 -2.566325
H -5.978567 1.076991 -2.170674
H -5.592189 2.564640 -1.222530
H 4.887862 1.429166 0.616931
H -0.190856 1.453740 3.724970
H -1.231880 0.510504 4.821714
H -1.952703 1.623370 3.624107
H 3.588292 -0.840313 -2.840543
H -3.642261 -4.480796 -0.588599
H -5.147974 -4.694988 0.342463
H -3.577259 -4.935389 1.129672


%chk=000266677-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266677

0 1
O -2.827676 0.300736 -1.783879
O -1.715729 0.810902 1.631807
O -2.752730 -2.263762 -0.175288
O -4.253872 1.108225 0.000788
O -2.159247 -0.523742 3.490423
O -4.974434 -2.857655 0.217294
O 3.760626 2.373990 2.049717
O 1.501393 2.129588 1.929387
O 5.969377 -1.022856 -2.722726
O 6.763002 0.326620 -1.056430
N 0.455301 0.615946 0.068537
N 2.714013 1.882366 1.483590
N 5.799913 -0.249952 -1.697145
C -0.780860 0.011425 -0.439044
C -1.630633 -0.407062 0.786880
C -1.589865 0.996716 -1.340856
C -3.030397 -0.910880 0.388223
C -3.729778 -0.051844 -0.685594
C -0.867256 1.413325 -2.619452
C 1.734163 0.411581 -0.363235
C -1.955525 0.610266 3.011790
C 2.870709 1.021459 0.309669
C -3.832335 -3.173481 -0.174487
C 2.036278 -0.417543 -1.501680
C -5.191145 1.888505 -0.826185
C 4.193655 0.803193 -0.130277
C -1.900258 1.928606 3.739634
C 3.340889 -0.635055 -1.930481
C -3.380472 -4.519582 -0.687010
C 4.421195 -0.019561 -1.238432
H -0.577511 -0.904171 -1.021888
H -1.131015 -1.204107 1.367075
H -1.872522 1.878126 -0.731739
H -3.690600 -1.008215 1.266053
H -4.535619 -0.625946 -1.181157
H 0.363011 1.249582 0.884859
H -0.652117 0.534536 -3.253361
H -1.505105 2.100147 -3.200766
H 0.079530 1.931307 -2.389773
H 1.213911 -0.881185 -2.050449
H -4.699270 2.252993 -1.746814
H -6.073550 1.274754 -1.095920
H -5.504980 2.737394 -0.200784
H 5.026807 1.273394 0.398386
H -0.883685 2.354965 3.660949
H -2.157827 1.781073 4.797849
H -2.597336 2.647299 3.276300
H 3.558752 -1.266615 -2.795783
H -2.797043 -4.405350 -1.615470
H -4.255363 -5.161349 -0.863643
H -2.724675 -5.001406 0.060139


