%chk=000296947.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296947

0 1
S 0.985194 -1.662397 0.404151
O -0.277305 -0.665041 -0.102063
O 1.016625 -2.767480 -0.524108
O 0.758664 -1.915117 1.807106
C -2.876384 0.905558 0.613108
C -4.911769 0.159201 -0.063423
C -2.527642 -0.105873 -0.526486
C -4.118133 0.240486 1.272499
C -3.926095 -0.637319 -0.964882
C -3.513082 2.157881 -0.054486
C -4.902047 1.644819 -0.525869
C -1.607151 -1.233256 -0.053372
C 2.301049 -0.594006 0.159450
C 2.716055 0.256093 1.192409
C 2.963946 -0.568278 -1.074178
C 3.784839 1.129039 0.995129
C 4.033354 0.302556 -1.277248
C 4.450109 1.160760 -0.243717
C 5.601701 2.084551 -0.453925
H -2.034249 1.126677 1.277775
H -5.911787 -0.282441 -0.000904
H -2.021496 0.421439 -1.365624
H -4.598372 0.863211 2.035561
H -3.912822 -0.734377 1.728162
H -4.034036 -1.719683 -0.802625
H -4.107427 -0.460108 -2.033959
H -2.906230 2.535919 -0.888705
H -3.611119 2.981932 0.667035
H -5.720539 2.210422 -0.057837
H -5.028801 1.739008 -1.612897
H -1.633907 -2.104015 -0.735949
H -1.817876 -1.552920 0.983958
H 2.204562 0.231448 2.162059
H 2.646809 -1.239168 -1.881499
H 4.104229 1.785817 1.802376
H 4.546064 0.316533 -2.237432
H 6.548770 1.593942 -0.176839
H 5.701618 2.403325 -1.501168
H 5.526281 2.998559 0.152018


%chk=000296947-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296947

0 1
S 1.009407 -1.858047 0.187498
O -0.355743 -0.700292 -0.345191
O 1.190288 -3.009108 -0.939678
O 0.758105 -2.268809 1.737394
C -2.774615 0.999310 0.325762
C -4.929555 0.245767 0.245996
C -2.689931 -0.205614 -0.665512
C -3.856221 0.522560 1.339244
C -4.172948 -0.750895 -0.681672
C -3.527088 2.154670 -0.400913
C -5.011164 1.627889 -0.471103
C -1.708916 -1.305031 -0.232644
C 2.401172 -0.613573 0.067216
C 2.715205 0.138096 1.210099
C 3.081849 -0.496106 -1.154334
C 3.778322 1.061542 1.111791
C 4.139933 0.436115 -1.224462
C 4.501893 1.224922 -0.099843
C 5.660878 2.200840 -0.180674
H -1.796372 1.288479 0.740818
H -5.902244 -0.133323 0.601160
H -2.379825 0.143199 -1.667970
H -4.154673 1.312778 2.051342
H -3.570301 -0.379375 1.910460
H -4.223464 -1.777716 -0.269787
H -4.594619 -0.781349 -1.702093
H -3.100833 2.358844 -1.399825
H -3.464202 3.089984 0.184774
H -5.702812 2.306124 0.061524
H -5.377624 1.529354 -1.509265
H -1.781075 -2.182294 -0.905165
H -1.888895 -1.621547 0.813557
H 2.158870 -0.005427 2.141648
H 2.802404 -1.117598 -2.010759
H 4.047442 1.663686 1.986943
H 4.689230 0.552651 -2.165488
H 6.609884 1.706128 0.103171
H 5.789767 2.595097 -1.203360
H 5.520070 3.055770 0.502945


