%chk=000267425.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267425

0 1
S -3.251179 1.478724 0.729724
O -2.221355 1.022359 -0.632958
O -0.038793 2.619853 -0.500203
O -1.992428 -1.581176 -0.151864
O -2.656150 0.912724 1.909536
O -3.430149 2.896383 0.601533
N 3.471452 0.092222 0.449320
N 2.724749 -1.124108 0.261279
N -1.007872 0.518248 -0.220998
N 0.311746 -1.518811 0.137203
C 1.360765 0.738027 -0.045698
C 1.352648 -0.717594 0.136723
C 2.654998 1.182967 0.088029
C 4.898932 0.045828 0.186140
C 0.098031 1.441504 -0.292404
C -0.972871 -0.944985 -0.097887
C 5.702876 0.943384 0.909161
C 5.452550 -0.865512 -0.724226
C -4.680574 0.657028 0.253275
C 7.083855 0.921308 0.703812
C 6.838250 -0.874973 -0.907319
C -4.774340 -0.733068 0.376776
C -5.756204 1.392653 -0.264738
C 7.651874 0.015084 -0.199269
C -5.948986 -1.388531 -0.009567
C -6.926954 0.738323 -0.649327
C -7.021807 -0.654104 -0.521257
H 3.052253 2.191804 0.010478
H 2.961245 -1.859698 0.944371
H 5.263195 1.638510 1.624413
H 4.816661 -1.552829 -1.286324
H 7.722081 1.613687 1.255406
H 7.283270 -1.579873 -1.611775
H -3.927816 -1.318171 0.766024
H -5.678538 2.482042 -0.366199
H 8.731818 0.003626 -0.350553
H -6.018479 -2.471848 0.083996
H -7.763624 1.307773 -1.050763
H -7.936626 -1.165179 -0.824674


%chk=000267425-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267425

0 1
S -3.077713 1.539313 0.383663
O -2.148244 1.009453 -1.516231
O 0.008380 2.679903 -1.198908
O -1.946779 -1.647189 -0.998193
O -2.008806 0.763557 1.350051
O -3.402051 3.114744 0.641158
N 3.477957 0.118534 -0.122048
N 2.688875 -1.046146 -0.220706
N -0.938372 0.491571 -1.201406
N 0.365604 -1.546492 -0.629123
C 1.388019 0.748029 -0.692049
C 1.376896 -0.688207 -0.532323
C 2.680696 1.200711 -0.433475
C 4.878368 0.057863 0.159891
C 0.155929 1.444351 -1.041592
C -0.879600 -1.000770 -0.920827
C 5.487602 1.134195 0.850850
C 5.637140 -1.067367 -0.247180
C -4.740980 0.634578 0.301203
C 6.870775 1.085186 1.117559
C 7.016154 -1.110340 0.048756
C -4.755970 -0.733486 -0.010685
C -5.884019 1.410571 0.561817
C 7.638873 -0.036620 0.725539
C -6.020804 -1.368500 -0.032709
C -7.133071 0.749389 0.533099
C -7.198987 -0.633694 0.240220
H 3.090493 2.205968 -0.490513
H 3.005592 -1.927042 0.185089
H 4.887681 1.981864 1.197627
H 5.173603 -1.876322 -0.821839
H 7.344127 1.915898 1.650648
H 7.605719 -1.977160 -0.266656
H -3.833396 -1.272821 -0.256905
H -5.794990 2.479405 0.779341
H 8.710065 -0.073564 0.946705
H -6.077328 -2.434717 -0.274787
H -8.047303 1.316217 0.737792
H -8.171630 -1.137260 0.216344


