%chk=000264207.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264207

0 1
S -2.166207 3.363311 -0.471023
S 0.287660 -0.068257 -1.449367
O 1.367657 2.785805 -1.510159
O 0.825021 0.988668 0.699343
O 2.244523 3.123792 0.550103
O -4.264288 4.193167 0.740095
O 0.049954 0.736914 2.809656
O -1.141143 -0.706582 -3.558393
C -1.137368 1.864815 -0.325458
C 0.067647 2.227433 0.548473
C -0.689898 1.469258 -1.723151
C 1.026592 3.208912 -0.171291
C 0.242897 2.496926 -2.357219
C -3.578722 3.220835 0.684478
C 0.798636 0.361752 1.932916
C -0.285136 -1.097662 -2.810896
C 3.281375 4.014715 0.072968
C -3.724173 1.922237 1.368577
C 1.765685 -0.757981 1.941908
C 0.387130 -2.412898 -2.821243
C -2.879087 1.573129 2.430531
C -4.739645 1.048206 0.949429
C 1.600130 -1.788227 2.881577
C 2.840281 -0.780277 1.039776
C -0.355591 -3.531953 -3.238090
C 1.727016 -2.562215 -2.435805
C -3.043451 0.337769 3.064289
C -4.898332 -0.181628 1.591579
C 2.510698 -2.845912 2.909679
C 3.747764 -1.842210 1.077015
C 0.237166 -4.795258 -3.251865
C 2.315163 -3.830999 -2.456861
C -4.050326 -0.537695 2.647049
C 3.582137 -2.872389 2.008448
C 1.572558 -4.945005 -2.859691
H -1.719439 1.032999 0.153258
H -0.216897 2.612014 1.556555
H -1.554226 1.244832 -2.402228
H 0.638684 4.247251 -0.216474
H 0.737419 2.119725 -3.275568
H -0.282840 3.443538 -2.591562
H 4.126159 3.753093 0.720859
H 2.979616 5.055603 0.213438
H 3.506739 3.797157 -0.976749
H -2.086649 2.246452 2.766513
H -5.401192 1.328307 0.128742
H 0.764966 -1.752325 3.584084
H 2.956032 0.037342 0.317886
H -1.393648 -3.403800 -3.552813
H 2.322507 -1.699238 -2.127596
H -2.367016 0.061525 3.876052
H -5.684408 -0.864001 1.269715
H 2.388507 -3.649177 3.634586
H 4.585694 -1.863361 0.382240
H -0.338442 -5.662931 -3.571100
H 3.355490 -3.949205 -2.157601
H -4.175295 -1.500052 3.143428
H 4.291665 -3.699475 2.035673
H 2.034551 -5.932071 -2.871512


%chk=000264207-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000264207

0 1
S -1.985347 3.232968 -0.408733
S 0.671910 -0.245921 -1.650571
O 1.829746 2.872252 -1.349462
O 1.366996 1.217228 0.990143
O 2.383982 3.780761 0.762195
O -4.665697 2.995701 -0.580630
O 0.226624 0.878047 2.999958
O -1.373402 -0.499413 -3.476255
C -0.677528 1.821852 -0.253030
C 0.461346 2.341537 0.659616
C -0.198285 1.454565 -1.673749
C 1.301009 3.400518 -0.073665
C 0.723486 2.536197 -2.262509
C -3.689736 2.463158 -0.014740
C 1.164060 0.575822 2.216149
C -0.429866 -1.103818 -2.906748
C 3.189231 4.888393 0.218304
C -3.784676 1.329713 0.945823
C 2.177877 -0.489400 2.447810
C -0.087478 -2.531945 -3.172020
C -2.885481 1.166707 2.031174
C -4.866562 0.418361 0.783498
C 2.085906 -1.258100 3.637401
C 3.218188 -0.742085 1.515072
C -0.813365 -3.202005 -4.195710
C 0.914403 -3.234453 -2.450516
C -3.050962 0.094413 2.932680
C -5.024187 -0.653789 1.683471
C 3.027355 -2.275843 3.892266
C 4.157249 -1.761857 1.776222
C -0.536514 -4.550527 -4.494863
C 1.186718 -4.584654 -2.752429
C -4.115536 -0.819630 2.757878
C 4.064171 -2.529535 2.961919
C 0.464537 -5.245415 -3.774476
H -1.190738 0.972545 0.223042
H 0.051973 2.758163 1.596213
H -1.062979 1.288252 -2.345195
H 0.639715 4.272936 -0.315703
H 1.198813 2.193436 -3.193230
H 0.115110 3.444440 -2.472816
H 3.930703 5.120212 0.997087
H 2.554668 5.778316 0.026208
H 3.691928 4.581116 -0.714434
H -2.074374 1.881041 2.199044
H -5.564587 0.565687 -0.047123
H 1.277784 -1.040372 4.343534
H 3.278985 -0.135783 0.607160
H -1.584429 -2.646596 -4.739422
H 1.473709 -2.734824 -1.651813
H -2.340267 -0.019125 3.756564
H -5.851800 -1.358807 1.550635
H 2.957401 -2.868241 4.810880
H 4.963809 -1.955199 1.060762
H -1.097249 -5.060360 -5.285610
H 1.957847 -5.122489 -2.190869
H -4.240334 -1.655687 3.455021
H 4.797185 -3.319250 3.162223
H 0.679252 -6.294513 -4.006428


