%chk=000268914.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268914

0 1
S 1.109897 -1.358427 0.390632
S 0.620113 1.647023 0.373771
S -1.737516 -0.279125 0.374087
O 6.791454 1.103732 -1.059849
O -2.436145 -6.435021 -1.058603
O -4.390877 5.374528 -0.950463
C 1.621585 0.271222 1.026352
C -0.588958 -1.534761 1.026648
C -1.047977 1.282932 1.011565
C 2.991250 0.491625 0.489251
C -1.078181 -2.833028 0.489799
C -1.922200 2.352939 0.460683
C 4.065441 0.675554 1.375636
C -1.472572 -3.848816 1.376382
C -2.618299 3.205312 1.341913
C 3.221016 0.517894 -0.902512
C -1.149909 -3.053151 -0.901923
C -2.061226 2.522738 -0.927933
C 5.359178 0.884290 0.895592
C -1.935213 -5.074998 0.896575
C -3.441809 4.213258 0.853589
C 4.501659 0.724236 -1.403635
C -1.607592 -4.266983 -1.402812
C -2.882677 3.528152 -1.441024
C 5.556905 0.905315 -0.492590
C -1.995406 -5.264770 -0.491571
C -3.561861 4.359817 -0.539980
H 1.582762 0.271262 2.139206
H -0.581071 -1.496559 2.139497
H -1.030691 1.261943 2.124741
H 3.894483 0.656490 2.452658
H -1.419673 -3.684931 2.453373
H -2.512815 3.076494 2.419989
H 2.389062 0.375354 -1.599333
H -0.844375 -2.266449 -1.598899
H -1.525315 1.866532 -1.620562
H 6.186173 1.026033 1.582945
H -2.238985 -5.856999 1.584082
H -3.987903 4.881943 1.515267
H 4.702313 0.748113 -2.472911
H -1.671130 -4.459005 -2.472051
H -2.988160 3.656976 -2.513315
H 7.499831 1.225770 -0.381217
H -2.696914 -7.104733 -0.379840
H -4.443371 5.438479 -1.935910


%chk=000268914-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268914

0 1
S 1.166303 -1.431964 -0.154798
S 0.652719 1.719895 -0.167145
S -1.821486 -0.300292 -0.175298
O 7.217734 1.176459 -0.549505
O -2.578579 -6.852317 -0.544066
O -4.630022 5.695458 -0.438399
C 1.651154 0.267433 0.555168
C -0.598542 -1.568855 0.549292
C -1.064818 1.294972 0.539301
C 3.116582 0.505477 0.285542
C -1.120544 -2.958982 0.281599
C -2.000210 2.446034 0.261412
C 4.029366 0.668646 1.355489
C -1.462865 -3.818378 1.353589
C -2.584576 3.176649 1.328280
C 3.607091 0.572218 -1.047628
C -1.277853 -3.431461 -1.050344
C -2.310592 2.819503 -1.071734
C 5.400925 0.893360 1.110626
C -1.951034 -5.120218 1.112074
C -3.456393 4.254112 1.080037
C 4.971246 0.795434 -1.305851
C -1.762895 -4.726512 -1.305239
C -3.181903 3.895452 -1.334427
C 5.868862 0.956315 -0.224182
C -2.099653 -5.571502 -0.221601
C -3.754184 4.612413 -0.254886
H 1.438364 0.237136 1.637982
H -0.530846 -1.365426 1.632097
H -0.935637 1.132859 1.623494
H 3.669095 0.621394 2.389580
H -1.348752 -3.470763 2.386795
H -2.355071 2.900889 2.364068
H 2.908690 0.447078 -1.882418
H -1.015670 -2.774440 -1.886871
H -1.865516 2.262341 -1.903337
H 6.095748 1.018118 1.951306
H -2.211974 -5.774116 1.954320
H -3.910791 4.823043 1.896169
H 5.359368 0.848142 -2.327128
H -1.887474 -5.100626 -2.325483
H -3.413600 4.174110 -2.370758
H 7.767045 1.276918 0.267263
H -2.786578 -7.369042 0.273698
H -4.777933 5.871234 -1.400781


