%chk=000242774.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242774

0 1
S -3.932424 -0.642848 -0.000579
S 3.932454 -0.642413 -0.001710
O -3.789253 -1.363122 -1.244784
O -3.788815 -1.366627 1.241547
O 3.787983 -1.367692 1.239450
O 3.790297 -1.361208 -1.246878
N -2.742661 0.608598 0.001001
N 2.742560 0.608907 0.000467
C -1.459427 0.515989 0.001294
C 1.459345 0.516154 0.000946
C -0.668892 1.779132 0.001795
C -0.668824 -0.747994 0.000048
C 0.668674 1.779203 0.001687
C 0.668893 -0.747919 -0.000086
C -5.403863 0.281113 0.000984
C 5.403790 0.281704 0.002058
H -1.255827 2.703792 0.002473
H -1.236253 -1.688018 -0.000486
H 1.255509 2.703930 0.002265
H 1.236428 -1.687875 -0.000643
H -5.503092 0.942367 -0.875105
H -6.305638 -0.350790 0.000193
H -5.502843 0.939824 0.879012
H 5.503559 0.944066 -0.873134
H 5.502085 0.939328 0.880976
H 6.305634 -0.350099 0.001109


%chk=000242774-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242774

0 1
S -3.817420 -0.751237 0.000057
S 3.817500 -0.750804 -0.007894
O -3.619508 -1.545759 -1.408896
O -3.612515 -1.548321 1.406646
O 3.607308 -1.557791 1.392333
O 3.625159 -1.535416 -1.423079
N -2.771537 0.895836 -0.001762
N 2.771401 0.896128 -0.004143
C -1.447948 0.740160 -0.002210
C 1.447829 0.740308 -0.003191
C -0.684166 2.004191 -0.002443
C -0.684513 -0.524421 0.000670
C 0.683917 2.004261 -0.002721
C 0.684529 -0.524353 0.000285
C -5.504081 0.117505 0.004979
C 5.503997 0.118092 0.009611
H -1.261552 2.933384 -0.003121
H -1.230950 -1.472434 0.003886
H 1.261207 2.933513 -0.003710
H 1.231070 -1.472304 0.004135
H -5.540613 0.726623 -0.907281
H -6.249882 -0.689245 0.006206
H -5.536078 0.725189 0.918366
H 5.543941 0.733474 -0.898288
H 5.532397 0.719483 0.927275
H 6.249909 -0.688557 0.008192


