%chk=000270361.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270361

0 1
S -2.311952 1.480987 -0.301346
S -2.307059 -1.538985 0.312222
O -1.282725 1.664719 -1.294554
O -3.674872 1.200259 -0.747649
O -2.107394 -2.318668 1.522102
O -1.513659 -1.839098 -0.857279
C -1.973914 0.161635 0.827331
C -0.529689 0.206215 1.344950
C 0.563415 0.050588 0.280816
C 1.951350 -0.012247 0.931009
C 3.051213 -0.137430 -0.132653
C -2.346119 2.904555 0.742953
C -4.010450 -1.562038 -0.086610
C 4.445361 -0.200930 0.504996
C 5.542125 -0.324056 -0.561224
C -2.699396 4.123643 -0.096652
C -4.364950 -2.902245 -0.710894
C 6.939012 -0.388381 0.072252
C 8.033688 -0.511006 -0.985612
H -2.626913 0.312076 1.727136
H -0.366295 1.149521 1.905643
H -0.403739 -0.598751 2.111032
H 0.394072 -0.863756 -0.334087
H 0.527390 0.879610 -0.460174
H 2.004941 -0.874296 1.624919
H 2.127587 0.889626 1.546964
H 2.875215 -1.042030 -0.748202
H 2.994282 0.715620 -0.836554
H -3.075779 2.805543 1.570278
H -1.370142 3.073887 1.243128
H -4.657423 -1.376208 0.793541
H -4.301715 -0.735635 -0.793791
H 4.619869 0.701285 1.121650
H 4.501018 -1.059546 1.201798
H 5.368189 -1.226701 -1.178425
H 5.486233 0.531375 -1.261513
H -2.716748 5.035625 0.514900
H -3.692486 4.030390 -0.562500
H -1.969175 4.293416 -0.903928
H -5.420234 -2.925250 -1.016221
H -4.213188 -3.739078 -0.014030
H -3.769049 -3.104764 -1.615433
H 7.114720 0.514640 0.688712
H 6.996126 -1.246913 0.769723
H 8.028570 0.343078 -1.672281
H 9.026645 -0.557014 -0.525225
H 7.909742 -1.416670 -1.590420


%chk=000270361-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270361

0 1
S -2.375083 1.578943 -0.344179
S -2.362973 -1.659007 0.213236
O -1.204061 1.874223 -1.437398
O -3.911675 1.241795 -0.825020
O -1.938179 -2.608556 1.483531
O -1.690359 -1.901511 -1.250199
C -1.893021 0.150617 0.924537
C -0.450957 0.158917 1.407724
C 0.646183 -0.105532 0.346107
C 2.056589 -0.013057 0.968012
C 3.172133 -0.269885 -0.069728
C -2.502604 3.173714 0.794675
C -4.318556 -1.699177 0.034361
C 4.596333 -0.169236 0.520874
C 5.705371 -0.403131 -0.529802
C -2.921127 4.334945 -0.101333
C -4.677265 -2.872480 -0.868188
C 7.134254 -0.302176 0.051271
C 8.232413 -0.524578 -1.011461
H -2.651387 0.289827 1.716965
H -0.258198 1.127992 1.917747
H -0.390161 -0.619239 2.198173
H 0.500120 -1.110597 -0.091091
H 0.549841 0.615159 -0.485929
H 2.149695 -0.746314 1.796629
H 2.203462 0.992481 1.418261
H 3.029697 -1.275315 -0.516439
H 3.067694 0.455960 -0.902484
H -3.248742 2.897854 1.557048
H -1.493799 3.279065 1.224641
H -4.644678 -1.802015 1.081984
H -4.541379 -0.703700 -0.388332
H 4.734270 0.832253 0.980848
H 4.707962 -0.907368 1.342704
H 5.568671 -1.403379 -0.991486
H 5.592443 0.334887 -1.351449
H -2.987903 5.256564 0.506043
H -3.907362 4.149554 -0.559701
H -2.182092 4.502938 -0.903257
H -5.770290 -2.860310 -1.038166
H -4.407711 -3.843267 -0.418891
H -4.178341 -2.781840 -1.847948
H 7.267234 0.694718 0.519714
H 7.249814 -1.046073 0.866000
H 8.158386 0.227487 -1.819648
H 9.244586 -0.451213 -0.572462
H 8.136449 -1.524340 -1.475696


