%chk=000268882.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268882

0 1
S 1.221702 0.674762 -1.450290
S 3.902109 -0.637792 1.570931
O 0.732167 2.754891 1.027600
O -0.475375 3.738625 -0.589085
O -3.906518 -2.487616 0.454484
O -2.243844 -3.289774 -0.676295
N -2.824173 -2.388899 -0.097217
C -0.303256 0.350389 -0.622800
C -0.922897 1.419251 0.033280
C -0.908882 -0.902709 -0.677608
C -2.158408 -1.060197 -0.058025
C -2.173932 1.254254 0.640112
C -2.797098 0.004318 0.595682
C 2.395254 -0.056979 -0.381219
C 3.304407 -1.062530 -0.876385
C -0.247054 2.751300 0.060413
C 2.586479 0.286539 0.922792
C 4.189527 -1.474999 0.072057
H -0.432410 -1.751250 -1.187517
H -2.661277 2.092283 1.144054
H -3.776407 -0.152209 1.065342
H 3.262706 -1.428477 -1.895599
H 2.040261 1.012515 1.512708
H 4.973711 -2.207523 -0.017701
H 1.230408 3.620227 1.057685


%chk=000268882-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268882

0 1
S 1.331732 0.814808 -1.476977
S 4.062005 -0.799081 1.599667
O 0.815688 2.998668 0.753437
O -1.175735 3.967343 0.061143
O -3.804279 -2.610076 0.381483
O -1.925669 -3.338743 -0.688843
N -2.635979 -2.418309 -0.130870
C -0.251568 0.492196 -0.568294
C -0.981770 1.536221 0.063612
C -0.801263 -0.805904 -0.629141
C -2.071312 -1.041741 -0.069598
C -2.286215 1.276982 0.568496
C -2.838740 -0.013242 0.518681
C 2.514853 -0.104345 -0.409574
C 3.204589 -1.296839 -0.850657
C -0.484931 2.940179 0.244889
C 2.858986 0.307602 0.867610
C 4.075036 -1.795157 0.102322
H -0.263531 -1.623521 -1.115825
H -2.850507 2.104032 1.009763
H -3.831780 -0.234760 0.916614
H 3.051322 -1.751301 -1.831716
H 2.490699 1.171265 1.417343
H 4.718139 -2.671460 0.054868
H 1.087429 3.953585 0.838967


