%chk=000233782.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233782

0 1
S -3.048878 0.572170 -0.000502
O -3.220072 1.282147 1.242219
O -3.219039 1.285986 -1.241176
O 0.538120 -2.873745 -0.002941
O 4.463284 0.942480 0.001814
N -0.342126 1.152185 0.000697
N 2.169879 1.506459 0.001693
N 2.755652 -0.701901 -0.000260
N -1.016333 -1.160668 -0.001698
C 0.993810 0.739630 0.000632
C 1.342021 -0.618756 -0.000566
C -1.282111 0.113490 -0.000547
C 0.334768 -1.684869 -0.001820
C 3.307270 0.597378 0.000997
C -3.914246 -0.916361 -0.003175
H -0.602338 2.137121 0.001503
H 2.240173 2.512573 0.002817
H 3.270082 -1.571241 -0.000793
H -3.690151 -1.566737 0.864954
H -5.009415 -0.793052 -0.003359
H -3.689552 -1.563989 -0.873189


%chk=000233782-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233782

0 1
S -3.054605 0.504554 0.504790
O -3.681962 0.468178 2.001813
O -2.852945 1.943524 -0.303686
O 0.982681 -2.911639 1.000483
O 4.394775 1.060048 -0.658737
N -0.404681 0.888422 -0.035895
N 2.015301 1.399447 -0.488742
N 2.822957 -0.614450 0.075531
N -0.824053 -1.354740 0.755858
C 0.946395 0.609491 -0.100965
C 1.432072 -0.656723 0.254783
C -1.175326 -0.166480 0.411682
C 0.588299 -1.756236 0.698776
C 3.245794 0.648289 -0.387962
C -4.029812 -0.709254 -0.596562
H -0.921384 1.757266 -0.299717
H 2.008529 2.371280 -0.794315
H 3.456997 -1.391750 0.254853
H -3.911009 -1.699414 -0.135452
H -5.068380 -0.351341 -0.568791
H -3.588846 -0.648170 -1.600448


