%chk=000272467.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272467

0 1
S -2.430482 -1.759646 0.337758
O -1.331681 -0.693648 -0.369150
O 1.943312 -0.197436 -2.087553
O -3.699275 -1.542588 -0.302585
O -2.311005 -1.587562 1.763049
C 0.133730 1.177965 -0.314014
C -1.224966 0.642666 0.193654
C 0.288145 2.654753 0.105877
C -2.399536 1.477477 -0.330871
C -0.880710 3.502075 -0.411390
C -2.229494 2.947412 0.067007
C 1.285517 0.347204 0.193406
C 2.123547 -0.339229 -0.707754
C 1.577523 0.236429 1.560123
C 3.218999 -1.099838 -0.281211
C 2.667174 -0.520210 2.002748
C 3.490908 -1.181438 1.085803
C -1.706276 -3.245496 -0.191956
C 0.964925 -1.113612 -2.642523
H 0.126416 1.133497 -1.437375
H -1.238453 0.553597 1.304154
H 1.246333 3.045572 -0.288640
H 0.357627 2.737835 1.206960
H -3.362827 1.082728 0.049366
H -2.464486 1.378918 -1.433173
H -0.860011 3.535299 -1.518302
H -0.762300 4.549051 -0.074088
H -2.313418 3.052649 1.166354
H -3.057291 3.546204 -0.358621
H 0.946338 0.744405 2.289611
H 3.845777 -1.598968 -1.016452
H 2.874882 -0.592517 3.068893
H 4.343244 -1.760859 1.436344
H -2.317981 -3.790859 -0.927903
H -0.723300 -3.095171 -0.671127
H -1.518177 -3.952345 0.632633
H 0.001523 -1.003921 -2.125380
H 1.343898 -2.135990 -2.579037
H 0.896853 -0.778906 -3.683635


%chk=000272467-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000272467

0 1
S -2.243615 -1.858819 0.630288
O -1.607504 -0.569792 -0.596951
O 1.846235 -0.099002 -2.227123
O -3.630789 -2.470923 0.076980
O -2.158846 -1.227463 2.126261
C 0.038400 1.230307 -0.374922
C -1.401437 0.779456 -0.005015
C 0.273073 2.661418 0.200408
C -2.473773 1.748934 -0.528412
C -0.793417 3.658716 -0.307675
C -2.223847 3.174492 0.026047
C 1.094041 0.235972 0.091641
C 1.946698 -0.413471 -0.843735
C 1.270282 -0.073889 1.465991
C 2.939276 -1.329473 -0.425803
C 2.252854 -0.993716 1.895383
C 3.094620 -1.622673 0.947047
C -0.844534 -3.117487 0.386354
C 0.978895 -1.019073 -2.992405
H 0.100362 1.301337 -1.477258
H -1.487530 0.693409 1.100651
H 1.288070 2.995468 -0.085101
H 0.248250 2.623757 1.308869
H -3.476112 1.385558 -0.235200
H -2.437620 1.762449 -1.635368
H -0.691831 3.773637 -1.406238
H -0.615359 4.656487 0.137218
H -2.364060 3.170906 1.126670
H -2.975715 3.871952 -0.388738
H 0.625083 0.403642 2.212735
H 3.590577 -1.783715 -1.180527
H 2.366080 -1.212137 2.962735
H 3.870264 -2.324009 1.273884
H -0.850391 -3.364381 -0.683384
H 0.075406 -2.604811 0.697389
H -1.095625 -3.978692 1.021526
H -0.055595 -1.001994 -2.597475
H 1.375529 -2.053573 -2.955218
H 0.998607 -0.653307 -4.030527


