%chk=000206972.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206972

0 1
S -4.649206 -0.703160 0.178223
O 0.543110 -0.512805 -0.192441
O 1.340769 -2.614949 -0.615649
O 0.563098 1.498687 3.232842
O -0.279267 -0.160110 2.140938
N 2.781617 -0.469350 -1.944171
N 0.585571 0.680088 2.325471
C 2.858788 0.136680 -0.698090
C 4.009150 0.847725 -0.262165
C 1.714894 0.064480 0.182792
C 1.734942 0.718022 1.412330
C 4.001575 1.503873 1.009561
C 2.895889 1.453603 1.813400
C 5.135599 0.886181 -1.146947
C -1.004687 -2.019876 -1.031546
C 0.416519 -1.862679 -0.659727
C -1.990588 -1.300050 -0.339334
C -3.328684 -1.491012 -0.680648
C 5.059881 0.266341 -2.367166
C -1.349987 -2.919154 -2.052153
C 3.843596 -0.403309 -2.737750
C -3.691132 -2.379604 -1.699402
C -2.697160 -3.092745 -2.379980
C -3.986042 0.827115 0.757962
C -3.191354 0.862540 1.905118
C -4.342611 1.995428 0.080531
C -2.732270 2.097987 2.376055
C -3.892110 3.226917 0.567908
C -3.085884 3.276606 1.711138
H 4.892212 2.050489 1.320853
H 2.864580 1.967070 2.782304
H 6.037508 1.411661 -0.830184
H -1.686462 -0.606132 0.457974
H 5.896225 0.269634 -3.065142
H -0.573663 -3.476094 -2.579394
H 3.764328 -0.890256 -3.719267
H -4.740409 -2.521195 -1.968353
H -2.976403 -3.787795 -3.171769
H -2.912787 -0.054339 2.431244
H -4.962221 1.954724 -0.815832
H -2.089751 2.134388 3.258327
H -4.165775 4.146521 0.053992
H -2.730300 4.236659 2.083647


%chk=000206972-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206972

0 1
S -4.793651 -0.209282 -0.793959
O 0.513037 -0.337926 -0.285857
O 1.319284 -2.526813 -0.577067
O 0.692030 1.492812 3.336262
O -0.039846 -0.441014 2.375308
N 2.649000 -0.152862 -2.066439
N 0.768614 0.560196 2.440152
C 2.832602 0.299516 -0.770379
C 4.061818 0.909925 -0.312372
C 1.735801 0.159934 0.153059
C 1.870809 0.663377 1.458352
C 4.153163 1.409854 1.027393
C 3.070093 1.306951 1.892799
C 5.139093 0.997714 -1.253418
C -1.039964 -2.016956 -0.996514
C 0.370171 -1.728906 -0.637505
C -2.054443 -1.045134 -0.811459
C -3.399729 -1.385631 -1.054561
C 4.957557 0.515693 -2.550199
C -1.360626 -3.314959 -1.471974
C 3.687609 -0.042130 -2.913769
C -3.727908 -2.679824 -1.532443
C -2.705304 -3.631124 -1.752667
C -4.059231 1.082530 0.305135
C -3.414798 0.745508 1.519498
C -4.219256 2.435752 -0.072451
C -2.899173 1.771814 2.342835
C -3.731512 3.458575 0.774917
C -3.063520 3.129316 1.976756
H 5.084026 1.879017 1.363740
H 3.104267 1.700596 2.911786
H 6.090061 1.445055 -0.943619
H -1.780299 -0.052127 -0.451864
H 5.758886 0.564717 -3.293533
H -0.560854 -4.050875 -1.600250
H 3.518661 -0.406830 -3.933439
H -4.774319 -2.947223 -1.717324
H -2.968837 -4.627312 -2.122918
H -3.298543 -0.302021 1.814748
H -4.708636 2.684186 -1.019865
H -2.367735 1.506476 3.262885
H -3.859908 4.507057 0.484069
H -2.667390 3.921183 2.621650


