%chk=000253493.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253493

0 1
S 3.026910 0.453925 -0.505632
O -1.115265 -1.958505 -0.238242
O -0.934967 1.884235 1.198006
O -2.448649 -2.527837 1.463955
C -2.420417 -0.211314 -1.282510
C -2.117359 1.217541 -0.794578
C -3.318884 -1.070503 -0.357374
C -1.143480 -1.088010 -1.421089
C -3.346255 1.870372 -0.142607
C -4.345523 -0.344830 0.512502
C -3.869978 1.017241 1.015194
C 0.199306 -0.365299 -1.450154
C -0.908675 1.290329 0.141806
C -2.328895 -1.907218 0.445938
C 0.348617 0.669550 -0.381975
C 1.523288 1.074397 0.123678
C 4.271230 1.179981 0.616209
C 5.631826 0.679507 0.151251
C 5.882028 -0.792269 0.511836
C 7.281804 -1.238576 0.097230
H -2.919319 -0.117245 -2.275634
H -1.832986 1.827752 -1.694427
H -3.883460 -1.798209 -1.002021
H -1.229776 -1.790439 -2.279662
H -4.137005 2.023574 -0.899903
H -3.070779 2.877012 0.235394
H -4.609727 -0.991741 1.378046
H -5.281588 -0.217709 -0.067923
H -3.070599 0.893432 1.778154
H -4.695708 1.539888 1.533823
H 0.362442 0.093571 -2.448907
H 0.997327 -1.142918 -1.337364
H 1.568241 1.811775 0.933319
H 4.062281 0.881940 1.660881
H 4.217490 2.283433 0.573553
H 5.755907 0.826593 -0.941993
H 6.420606 1.310349 0.615136
H 5.747408 -0.943367 1.601134
H 5.124517 -1.440139 0.025987
H 7.451229 -2.290848 0.354837
H 8.061257 -0.651567 0.595815
H 7.435380 -1.139755 -0.983491


%chk=000253493-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253493

0 1
S 3.070281 0.302560 -0.663595
O -0.994687 -1.805791 -0.171844
O -0.819749 2.237717 0.892251
O -2.251116 -2.283915 1.724180
C -2.508862 -0.253453 -1.280869
C -2.222987 1.229279 -0.857846
C -3.289351 -1.097661 -0.229638
C -1.212500 -1.092577 -1.478630
C -3.417601 1.874205 -0.119218
C -4.344787 -0.368300 0.626960
C -3.862645 1.022021 1.088983
C 0.051462 -0.272567 -1.766172
C -0.892944 1.440273 -0.094306
C -2.183746 -1.779366 0.593133
C 0.290697 0.732982 -0.655781
C 1.519223 1.015639 -0.122481
C 4.228083 1.016222 0.680069
C 5.685120 0.635850 0.378416
C 5.979158 -0.880494 0.460422
C 7.468687 -1.201927 0.216253
H -3.074976 -0.224420 -2.229304
H -2.060627 1.784832 -1.809888
H -3.788561 -1.931255 -0.770463
H -1.361136 -1.877026 -2.244314
H -4.266982 1.990213 -0.823408
H -3.119145 2.881309 0.220407
H -4.588718 -1.008087 1.495646
H -5.271488 -0.252717 0.030551
H -3.021244 0.925323 1.800295
H -4.679984 1.533400 1.630906
H -0.075585 0.227521 -2.749342
H 0.915776 -0.954853 -1.864471
H 1.576288 1.737849 0.702863
H 3.891502 0.604433 1.646525
H 4.083804 2.109856 0.669400
H 5.973512 1.021783 -0.619797
H 6.324124 1.166925 1.114071
H 5.673624 -1.255465 1.458052
H 5.355197 -1.420589 -0.278144
H 7.660113 -2.288031 0.283973
H 8.112802 -0.698423 0.961838
H 7.789769 -0.865179 -0.787486


