%chk=000270331.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270331

0 1
S 1.519104 1.255823 1.190975
S -0.583925 -0.703700 0.155989
O 1.849816 2.584366 0.698262
O 1.638207 1.024229 2.620656
O 0.130582 -1.669702 0.978476
O -0.348653 -0.698261 -1.276941
C -0.207782 0.880824 0.842832
C -0.901552 2.007382 0.038172
C -0.242458 2.274244 -1.315429
C -0.984265 3.300180 0.859815
C 2.454928 0.111372 0.317101
C -2.284109 -0.900421 0.436038
C 2.987105 0.458212 -0.933030
C -3.191948 -0.688593 -0.605937
C 2.743843 -1.141340 0.872912
C -2.740617 -1.317471 1.690239
C 3.791297 -0.444303 -1.629488
C -4.561707 -0.862741 -0.386125
C 3.553083 -2.046923 0.176686
C -4.109497 -1.492370 1.912787
C 4.070825 -1.700009 -1.073254
C -5.019227 -1.261519 0.874530
H -0.682326 0.909853 1.867864
H -1.959433 1.678181 -0.152438
H -0.865703 2.930597 -1.932220
H 0.727582 2.785940 -1.203756
H -0.073735 1.353393 -1.895323
H 0.014005 3.752077 1.007850
H -1.425536 3.146700 1.847773
H -1.585385 4.055345 0.341510
H 2.777882 1.444003 -1.362362
H -2.830499 -0.396986 -1.599362
H 2.325198 -1.424287 1.848480
H -2.028994 -1.523247 2.497375
H 4.196421 -0.176524 -2.603109
H -5.269447 -0.695223 -1.196923
H 3.764487 -3.023832 0.608269
H -4.465908 -1.815207 2.890250
H 4.694870 -2.407822 -1.620229
H -6.087728 -1.398639 1.047384


%chk=000270331-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270331

0 1
S 1.678616 1.241832 1.283923
S -0.657764 -0.818237 0.269344
O 2.103021 2.747462 0.795490
O 1.791074 0.819959 2.855749
O 0.045259 -1.831103 1.342720
O -0.370027 -0.925347 -1.336292
C -0.291344 1.032073 0.896098
C -0.928009 2.111700 0.026806
C -0.255987 2.323749 -1.354136
C -1.032855 3.440414 0.828950
C 2.700159 0.023642 0.248297
C -2.539020 -0.961051 0.519169
C 3.181467 0.471227 -0.991511
C -3.366528 -0.766946 -0.598146
C 2.993889 -1.226488 0.813797
C -3.003135 -1.324109 1.793895
C 4.004155 -0.413322 -1.724891
C -4.760250 -0.923500 -0.411326
C 3.823087 -2.091448 0.063164
C -4.400314 -1.472799 1.959420
C 4.318807 -1.688785 -1.199059
C -5.271743 -1.267275 0.862891
H -0.661519 0.976763 1.936676
H -1.969494 1.758835 -0.152012
H -0.893338 2.985800 -1.966740
H 0.723944 2.813617 -1.227569
H -0.125919 1.368843 -1.891822
H -0.028290 3.850153 1.025612
H -1.556047 3.298442 1.792766
H -1.603796 4.176654 0.234818
H 2.945433 1.475587 -1.356304
H -2.931467 -0.537566 -1.577012
H 2.594225 -1.507104 1.791307
H -2.300361 -1.515735 2.611956
H 4.398359 -0.104037 -2.698257
H -5.439867 -0.784777 -1.258442
H 4.071882 -3.079089 0.464220
H -4.802796 -1.756721 2.937190
H 4.957092 -2.369194 -1.773284
H -6.351794 -1.388515 0.998844


