%chk=000214504.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214504

0 1
S -0.397859 0.242277 -0.248247
O -0.135095 -0.774481 -1.240874
O 0.291876 1.517708 -0.313929
O 7.109381 1.134124 -1.548727
O 7.162389 0.816220 0.663242
O -6.546697 -0.961655 0.246887
O -4.926663 -2.392095 0.375169
N -0.094271 -0.440613 1.300189
N -5.365498 -1.263665 0.235946
C 2.319402 -1.179725 1.591405
C 2.939300 -0.443336 0.398419
C 0.855398 -1.584307 1.357013
C 4.448754 -0.254752 0.587625
C 5.053616 0.528795 -0.582353
C -2.105190 0.570396 -0.174818
C -3.015081 -0.470818 -0.000809
C -2.552887 1.890034 -0.310177
C 6.503878 0.815740 -0.349340
C -4.386851 -0.171711 0.042505
C -3.922202 2.178429 -0.271358
C -4.847504 1.149873 -0.095186
H 2.904512 -2.097791 1.808310
H 2.406281 -0.557860 2.503920
H 2.740893 -1.002438 -0.539276
H 2.454428 0.547789 0.264305
H 0.516347 -2.245053 2.190738
H 0.764948 -2.193987 0.424675
H 4.656326 0.277591 1.539620
H 4.952004 -1.237914 0.681604
H 0.082854 0.223656 2.067369
H 4.919340 -0.018389 -1.542490
H 4.513906 1.492781 -0.732841
H -2.684550 -1.515707 0.103314
H -1.825583 2.704355 -0.447945
H -4.266084 3.208634 -0.380689
H -5.925301 1.354836 -0.062294
H 8.073783 1.348658 -1.448200


%chk=000214504-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214504

0 1
S -0.373392 0.287082 -0.183983
O -0.136424 -1.009990 -1.139815
O 0.325667 1.736607 -0.474366
O 7.082634 1.225723 -1.768219
O 7.326568 0.479740 0.415845
O -6.702638 -1.050533 -0.232602
O -4.966933 -2.526902 -0.356093
N -0.028262 -0.276137 1.581991
N -5.445028 -1.334446 -0.258715
C 2.403620 -1.115957 1.750793
C 2.997458 -0.489134 0.468642
C 0.896589 -1.445539 1.670343
C 4.516903 -0.243605 0.594289
C 5.100153 0.400726 -0.677252
C -2.236211 0.605139 -0.107164
C -3.098824 -0.493271 -0.200097
C -2.667568 1.937214 -0.001352
C 6.585865 0.680347 -0.571841
C -4.478670 -0.203570 -0.167552
C -4.060883 2.183919 0.026417
C -4.975741 1.113590 -0.052048
H 2.939089 -2.061526 1.973378
H 2.589655 -0.446539 2.617522
H 2.791142 -1.156731 -0.391939
H 2.492562 0.472304 0.240573
H 0.571632 -1.999608 2.572584
H 0.685408 -2.092471 0.796475
H 4.725167 0.409677 1.463649
H 5.040655 -1.197797 0.797252
H 0.348412 0.574041 2.048060
H 4.934540 -0.240933 -1.564505
H 4.589776 1.356809 -0.907362
H -2.739437 -1.520587 -0.309314
H -1.933207 2.748792 0.032365
H -4.428715 3.211128 0.105562
H -6.056599 1.275712 -0.033822
H 8.057337 1.402324 -1.664995


