%chk=000269613.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269613

0 1
S 3.530122 -0.840986 -0.418724
O 1.991801 -0.213824 -0.996795
O 3.184438 -1.742490 0.638320
O 4.167725 -1.303112 -1.606075
O -0.415637 2.680353 -1.144312
O 1.431806 2.138784 -0.180563
N 0.313477 1.866324 -0.607156
C -1.526363 0.190651 -0.117438
C -1.873287 -1.163235 0.146709
C -0.152409 0.491782 -0.425899
C 0.776082 -0.549983 -0.535857
C -0.874371 -2.189786 0.082005
C 0.420412 -1.902059 -0.254519
C -2.548544 1.184954 -0.047115
C -3.223789 -1.490797 0.478713
C -3.839801 0.840392 0.274246
C -4.185896 -0.512698 0.543293
C 4.167165 0.644697 0.148837
H -1.169425 -3.219142 0.305351
H 1.189198 -2.678434 -0.290889
H -2.298745 2.227458 -0.272046
H -3.474813 -2.532642 0.679290
H -4.618885 1.602728 0.323678
H -5.216955 -0.754962 0.795771
H 5.054901 1.003252 -0.399199
H 3.434761 1.489816 0.054668
H 4.439728 0.650357 1.217407


%chk=000269613-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269613

0 1
S 3.485209 -0.658277 0.235057
O 2.022190 -0.429292 -1.201157
O 2.783939 -0.658788 1.695865
O 4.416281 -1.900085 -0.226587
O -0.337635 2.632826 -1.189538
O 1.452816 2.031718 0.080382
N 0.347773 1.758812 -0.529729
C -1.534462 0.131677 -0.125329
C -1.964243 -1.254145 -0.043217
C -0.158056 0.374114 -0.460564
C 0.747962 -0.678280 -0.759037
C -1.035329 -2.308820 -0.337730
C 0.278198 -2.034017 -0.694039
C -2.485623 1.164845 0.177359
C -3.312324 -1.549517 0.333290
C -3.790858 0.838280 0.550833
C -4.213962 -0.524841 0.627803
C 4.381633 0.977896 -0.129201
H -1.384297 -3.345910 -0.282220
H 0.989077 -2.827270 -0.943955
H -2.190643 2.213697 0.099997
H -3.623638 -2.598617 0.390986
H -4.502412 1.638102 0.780669
H -5.243466 -0.759401 0.917187
H 4.690819 0.905329 -1.180338
H 3.631242 1.760327 0.039150
H 5.232505 1.017034 0.565763


