%chk=000240612.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240612

0 1
S 0.990127 0.801677 0.182694
S -1.963439 -0.011250 0.517790
O 0.422908 2.147975 0.142616
O 1.411520 0.191524 -1.053986
O -2.697765 -0.731987 1.543985
O -2.065135 -0.445550 -0.856227
C -0.239034 -0.131338 1.047165
C 0.114793 -1.623406 1.112269
C 0.219337 -2.341683 -0.238184
C 2.355396 0.802164 1.302908
C -2.354908 1.689145 0.648063
C 0.450681 -3.845892 -0.040651
C 3.478858 1.640570 0.710621
C -3.731319 1.937764 0.052082
C 0.582496 -4.566249 -1.380718
H -0.249357 0.228022 2.109919
H 1.062514 -1.754882 1.673899
H -0.654019 -2.141795 1.737498
H 1.031839 -1.912281 -0.864826
H -0.698832 -2.180997 -0.849444
H 2.085373 1.202915 2.299459
H 2.728304 -0.224104 1.500424
H -2.328198 2.054366 1.693812
H -1.602800 2.348179 0.130457
H -0.389295 -4.284794 0.534284
H 1.361279 -4.017217 0.564847
H 4.355351 1.654350 1.372086
H 3.817417 1.247772 -0.261393
H 3.175675 2.687713 0.557241
H -3.981693 3.007359 0.077246
H -3.784891 1.624635 -1.003081
H -4.523960 1.408626 0.600409
H 0.742156 -5.640561 -1.242244
H -0.320431 -4.442544 -1.992181
H 1.422653 -4.177125 -1.968037


%chk=000240612-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240612

0 1
S 1.045957 0.884070 0.148356
S -2.092910 -0.037967 0.434732
O 0.397504 2.393205 0.245315
O 1.523439 0.274558 -1.284141
O -2.909709 -1.040663 1.446383
O -2.169467 -0.262341 -1.176636
C -0.221271 -0.282382 1.099506
C 0.127505 -1.761900 1.127499
C 0.174799 -2.507085 -0.230528
C 2.620345 0.895886 1.323012
C -2.592414 1.817880 0.852960
C 0.511609 -4.000499 -0.023063
C 3.632828 1.858850 0.711965
C -3.772592 2.193754 -0.032917
C 0.547821 -4.780991 -1.354220
H -0.267606 0.203773 2.091309
H 1.094827 -1.884997 1.661724
H -0.639500 -2.238442 1.775332
H 0.918023 -2.037449 -0.900616
H -0.803085 -2.414484 -0.738302
H 2.221599 1.217478 2.298634
H 2.950609 -0.154931 1.339471
H -2.818602 1.754932 1.929582
H -1.661010 2.373404 0.642783
H -0.240268 -4.457251 0.652877
H 1.492767 -4.093949 0.488548
H 4.536765 1.887213 1.348254
H 3.932345 1.531615 -0.298310
H 3.221561 2.880544 0.647662
H -4.010313 3.260558 0.138226
H -3.520566 2.067071 -1.099407
H -4.672897 1.597821 0.193104
H 0.789430 -5.847225 -1.191205
H -0.430379 -4.728622 -1.866837
H 1.306458 -4.360333 -2.040248


