%chk=000180067.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180067

0 1
S -0.338678 -1.215806 0.663897
S -2.375520 -1.331659 1.237390
O -1.632752 0.350850 -1.685908
N 1.382217 -0.578360 -0.057071
C 0.806397 0.817627 -0.292145
C -0.519528 0.625425 0.454861
C 1.778676 1.836555 0.324489
C 2.942404 1.031689 0.931402
C 2.502192 -0.443539 0.943031
C -1.802864 0.835840 -0.348050
C -2.976083 0.132771 0.333449
C 1.797639 -1.286204 -1.300844
H 0.631842 1.021770 -1.376792
H -0.563198 1.143908 1.431430
H 1.279583 2.451230 1.095551
H 2.141932 2.547480 -0.437776
H 3.862810 1.164838 0.335897
H 3.181883 1.380437 1.951030
H 3.339449 -1.131870 0.724120
H 2.105628 -0.732817 1.943665
H -2.008391 1.918978 -0.521855
H -3.491491 0.795100 1.051331
H -3.730451 -0.182555 -0.412492
H 2.037575 -2.338400 -1.066299
H 2.668042 -0.826276 -1.792467
H 0.962019 -1.306263 -2.024378
H -1.571633 -0.635050 -1.693366


%chk=000180067-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180067

0 1
S -0.586406 -1.282391 0.999498
S -2.931590 -0.962447 1.464213
O -1.549282 -0.236713 -1.723893
N 1.552675 -0.557432 -0.034069
C 0.826496 0.775281 -0.084392
C -0.609626 0.541764 0.438179
C 1.677152 1.734166 0.796174
C 3.094896 1.111240 0.779008
C 2.781724 -0.404435 0.812571
C -1.765107 0.662858 -0.583203
C -3.116148 0.384267 0.115615
C 1.762728 -1.220588 -1.341129
H 0.793613 1.125352 -1.135096
H -0.843862 1.155691 1.325733
H 1.285545 1.739656 1.830820
H 1.653083 2.770500 0.418960
H 3.627452 1.373288 -0.154679
H 3.715682 1.436533 1.631475
H 3.598595 -1.032760 0.417190
H 2.557820 -0.734357 1.843944
H -1.777258 1.673440 -1.032740
H -3.489521 1.291025 0.621505
H -3.847098 0.039949 -0.632837
H 2.027480 -2.279642 -1.179723
H 2.569924 -0.737941 -1.936880
H 0.827342 -1.175275 -1.922096
H -1.426609 -1.145328 -1.322046


