%chk=000268641.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268641

0 1
S -2.557244 0.894480 1.687588
O 3.490940 -0.298361 0.094079
O 2.152445 2.075849 0.079896
O 1.963816 -2.719654 -0.455824
O -4.832948 -0.397453 -1.264634
O -5.343802 0.558704 0.697883
C -0.665993 -0.260732 -0.511044
C 2.131946 -0.253154 -0.175630
C 1.385546 0.955126 -0.125119
C 1.437991 -1.459793 -0.393837
C -0.001243 0.958630 -0.300784
C 0.035077 -1.463089 -0.565476
C -2.126686 -0.283767 -0.717168
C -3.027896 0.188173 0.153502
C 4.309311 0.493896 -0.810605
C 1.466619 3.347954 0.213314
C 3.392937 -2.889651 -0.257942
C -4.485279 0.157583 -0.057597
H -0.570176 1.883127 -0.264243
H -0.467180 -2.415656 -0.723189
H -2.454543 -0.738836 -1.665895
H 4.080512 1.558852 -0.679255
H 4.152924 0.177220 -1.843132
H 5.320502 0.262208 -0.460950
H 0.768034 3.317146 1.055662
H 0.966585 3.608435 -0.723432
H 2.302789 4.027562 0.421904
H 3.697927 -2.453225 0.701021
H 3.937730 -2.428006 -1.085480
H 3.487635 -3.981275 -0.259930
H -3.794111 1.162568 2.183494
H -5.822064 -0.417560 -1.398579


%chk=000268641-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268641

0 1
S -2.844029 2.249329 0.418131
O 3.645344 -0.280701 -0.435512
O 2.269685 2.046369 0.344188
O 2.171338 -2.610753 -1.116225
O -4.694344 -1.236470 -0.543906
O -5.488647 0.857329 0.054951
C -0.621537 -0.281506 -0.323327
C 2.247018 -0.236108 -0.393272
C 1.501191 0.923797 -0.006217
C 1.532211 -1.434109 -0.690800
C 0.093380 0.906258 0.015580
C 0.125344 -1.446461 -0.658264
C -2.074466 -0.403906 -0.339479
C -3.079968 0.502037 -0.071546
C 4.349039 0.755497 -1.227770
C 1.552562 3.246650 0.792518
C 3.199464 -3.182404 -0.217789
C -4.501792 0.099914 -0.169428
H -0.449797 1.805783 0.306237
H -0.382098 -2.381487 -0.916567
H -2.443073 -1.399827 -0.618193
H 4.195843 1.752182 -0.785657
H 3.991969 0.738366 -2.274246
H 5.409759 0.465529 -1.186594
H 0.949210 3.035289 1.695372
H 0.899928 3.647606 -0.006148
H 2.340926 3.974944 1.032517
H 2.740229 -3.475857 0.746083
H 4.016633 -2.462982 -0.047592
H 3.569075 -4.076095 -0.743029
H -4.215971 2.479208 0.497834
H -5.672325 -1.410120 -0.583252


