%chk=000265172.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265172

0 1
S -0.396739 0.312614 0.865186
O -0.042488 1.651460 1.284182
O -0.096355 -0.821144 1.731318
O -0.714695 -1.461907 -2.203794
C 0.397934 -0.009393 -0.706855
C 1.886645 0.171173 -0.615218
C -2.081568 0.281726 0.472183
C 0.039689 -1.387348 -1.261204
C 2.549718 0.844908 -1.654787
C 2.626197 -0.329831 0.467566
C -2.793112 -0.921409 0.512379
C -2.737782 1.473072 0.144952
C 0.630701 -2.580098 -0.592345
C 3.934872 1.020515 -1.605161
C 4.010738 -0.147674 0.510524
C -4.155758 -0.939035 0.200828
C -4.099919 1.458471 -0.167108
C 4.669058 0.525615 -0.523143
C -4.806881 0.250791 -0.142873
H 0.002079 0.740355 -1.451959
H 1.988558 1.234546 -2.502456
H 2.131442 -0.857698 1.290671
H -2.289367 -1.851393 0.796025
H -2.189332 2.421861 0.144674
H 1.717023 -2.642859 -0.764384
H 0.500259 -2.553119 0.509321
H 0.187504 -3.515441 -0.962002
H 4.442250 1.547219 -2.412456
H 4.577388 -0.530427 1.359188
H -4.708168 -1.877491 0.225252
H -4.610140 2.385375 -0.425389
H 5.747282 0.667278 -0.483569
H -5.869532 0.237586 -0.389744


%chk=000265172-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000265172

0 1
S -0.436653 0.127652 0.875517
O 0.105400 1.611577 1.289455
O -0.273727 -1.145380 1.900314
O -0.896718 -2.031207 -1.872716
C 0.573056 -0.402454 -0.924134
C 1.991462 0.012056 -0.740727
C -2.269404 0.293484 0.432814
C 0.136194 -1.842978 -1.164514
C 2.508594 1.019950 -1.601407
C 2.836478 -0.524391 0.272245
C -3.087760 -0.842526 0.535360
C -2.729482 1.568367 0.063706
C 0.895273 -2.985531 -0.528720
C 3.846754 1.449944 -1.486339
C 4.168487 -0.081998 0.394128
C -4.459573 -0.684950 0.230300
C -4.104865 1.702859 -0.236318
C 4.682516 0.897348 -0.489091
C -4.962162 0.579438 -0.157852
H 0.012926 0.250317 -1.613261
H 1.858418 1.459489 -2.367244
H 2.440276 -1.250625 0.988844
H -2.674792 -1.803643 0.855995
H -2.045054 2.422899 0.045657
H 1.971470 -2.945548 -0.770979
H 0.794237 -2.904619 0.572353
H 0.469565 -3.942113 -0.867683
H 4.232605 2.219793 -2.163061
H 4.804031 -0.490491 1.187161
H -5.129716 -1.548135 0.295407
H -4.503579 2.681585 -0.522681
H 5.719512 1.236546 -0.390479
H -6.026268 0.691583 -0.392243


