%chk=000268658.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268658

0 1
S -0.041159 1.785093 -0.081027
O -3.142831 -0.655410 -0.047461
O -3.013581 1.599799 -0.099719
C 1.200107 -0.501807 -0.010452
C -0.230106 -0.814298 -0.014414
C 1.454534 0.888752 -0.044789
C -1.000388 0.313685 -0.050730
C 2.287460 -1.394840 0.022166
C -0.715384 -2.210794 0.018129
C 2.751871 1.406786 -0.047371
C 3.580587 -0.885918 0.019829
C 3.812054 0.506185 -0.014714
C -2.435108 0.536386 -0.068864
C -4.590642 -0.533626 -0.060411
H 2.110378 -2.468593 0.048757
H -1.820631 -2.271418 0.015306
H -0.363311 -2.780869 -0.855013
H -0.370000 -2.737658 0.920523
H 2.926170 2.480961 -0.074106
H 4.432787 -1.563724 0.044867
H 4.838226 0.874289 -0.015651
H -4.920803 -0.013922 0.844753
H -4.917817 -1.577539 -0.078809
H -4.907114 0.013282 -0.954699


%chk=000268658-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268658

0 1
S -0.058300 1.868618 -0.081325
O -3.205403 -0.690228 -0.045672
O -3.030935 1.632868 -0.098561
C 1.207301 -0.501290 -0.011041
C -0.212110 -0.832716 -0.015661
C 1.467233 0.905910 -0.043565
C -1.013281 0.307572 -0.051645
C 2.310226 -1.400486 0.021103
C -0.678350 -2.268611 0.015990
C 2.779918 1.422124 -0.044612
C 3.620962 -0.893677 0.020179
C 3.855412 0.510610 -0.012483
C -2.470688 0.505866 -0.070116
C -4.677995 -0.513049 -0.059901
H 2.133756 -2.481174 0.046296
H -1.773245 -2.337761 0.010790
H -0.282617 -2.819142 -0.858894
H -0.293381 -2.776327 0.921006
H 2.964254 2.500823 -0.069642
H 4.472601 -1.581864 0.044737
H 4.883340 0.889093 -0.012604
H -5.003508 0.049640 0.830927
H -5.080980 -1.535671 -0.053571
H -4.988911 0.033672 -0.965634


