%chk=000230714.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230714

0 1
S 1.389421 -2.800889 0.068038
S 1.509612 2.743752 0.054606
S -3.114407 0.067646 -0.046526
O 0.548000 -3.756872 -0.613129
O 2.811230 -2.687001 -0.259705
O 1.104962 3.487790 1.220200
O 2.934141 2.545222 -0.222080
O -3.626365 -1.047212 0.720942
O -3.545347 1.428795 0.201486
N 2.782539 -0.060233 -0.163784
N 1.342623 -3.220153 1.726326
N 0.873088 3.601971 -1.287833
N -3.526003 -0.272721 -1.679231
C 0.674472 -1.248847 -0.014003
C 0.726247 1.223397 -0.009747
C 1.432175 -0.028241 -0.063604
C -1.399386 0.029172 -0.025571
C -0.715732 -1.191232 -0.016358
C -0.665221 1.220878 0.004983
H -1.299600 -2.130190 -0.007944
H -1.218990 2.177911 0.045365
H 3.314215 -0.949389 -0.258553
H 3.360422 0.804546 -0.222916
H 0.726869 -3.973953 2.026344
H 2.216212 -3.272995 2.245760
H 0.433491 4.505933 -1.115161
H 1.432824 3.663917 -2.136096
H -4.026432 -1.136032 -1.881786
H -3.911661 0.476832 -2.248925


%chk=000230714-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230714

0 1
S 1.494152 -2.856390 -0.067474
S 1.347306 2.906457 0.077224
S -3.363967 -0.110007 0.058372
O 0.450074 -3.971055 -0.617768
O 2.983108 -2.667169 -0.724577
O 0.237427 3.978550 0.580407
O 2.829114 2.801373 0.767313
O -3.762921 -1.638919 0.453696
O -3.878822 1.205312 0.864655
N 2.728169 0.061324 0.000915
N 1.854610 -3.085816 1.704668
N 1.737656 3.122938 -1.693220
N -3.839954 0.195093 -1.691711
C 0.606941 -1.194888 -0.058743
C 0.542792 1.203064 0.069508
C 1.367930 0.025030 0.000972
C -1.496685 -0.050155 0.010564
C -0.787797 -1.257129 -0.080399
C -0.852665 1.193261 0.101557
H -1.310009 -2.220361 -0.140179
H -1.419607 2.126199 0.212231
H 3.249582 -0.802958 -0.201458
H 3.205265 0.948535 0.211108
H 1.061799 -3.537732 2.187464
H 2.748909 -3.594329 1.797527
H 0.937896 3.538790 -2.196714
H 2.611087 3.669163 -1.772063
H -4.132144 -0.697730 -2.123044
H -4.585845 0.911350 -1.689732


