%chk=000275952.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275952

0 1
S 3.687654 -0.300554 1.609083
S -3.966631 -0.475354 -1.374245
O 2.553107 -1.005579 0.552024
O -2.625872 -0.924784 -0.434388
O 0.929664 -2.454397 -1.073277
O -0.676560 -3.736295 0.542729
O 4.371326 -1.394281 2.245352
O 2.922607 0.635912 2.395332
O -4.802278 -1.649229 -1.438303
O -3.430961 0.100754 -2.580137
C 0.373684 -1.619988 -0.038742
C -0.934325 -2.348576 0.349915
C 1.351752 -1.531994 1.143217
C -2.011060 -2.187610 -0.742273
C 4.676030 0.476815 0.453386
C -4.624495 0.723329 -0.346170
C 5.813314 -0.172009 -0.047169
C -5.542518 0.365775 0.650174
C 4.352032 1.763124 0.001006
C -4.244616 2.063524 -0.495714
C 6.295447 1.746785 -1.452361
C -5.695501 2.685070 1.347308
C 6.619223 0.456488 -0.994021
C -6.076514 1.338797 1.493042
C 5.154813 2.396210 -0.945743
C -4.775270 3.040704 0.344504
C 7.145840 2.414058 -2.478385
C -6.251420 3.724979 2.259547
H 0.178125 -0.616056 -0.479941
H -1.329494 -2.004557 1.334631
H 0.980691 -0.856653 1.937861
H 1.585551 -2.531851 1.560967
H -1.580565 -2.149561 -1.760503
H -2.763944 -2.998826 -0.672819
H 1.893829 -2.259473 -1.168557
H -0.095978 -4.074713 -0.191854
H 6.074815 -1.175325 0.311250
H -5.848445 -0.681059 0.764862
H 3.468312 2.277786 0.396236
H -3.532571 2.347364 -1.279924
H 7.500933 -0.053305 -1.379834
H -6.788724 1.054563 2.266086
H 4.896895 3.395119 -1.294542
H -4.475296 4.080309 0.224183
H 6.795254 2.167094 -3.494063
H 7.130432 3.510165 -2.394353
H 8.199442 2.104870 -2.421595
H -7.265605 3.482951 2.608098
H -5.621425 3.829961 3.157943
H -6.304000 4.717023 1.789078


%chk=000275952-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000275952

0 1
S 3.810965 -0.455544 1.654600
S -4.237260 -0.740842 -1.408773
O 2.380719 -0.780515 0.475380
O -2.616569 -1.059141 -0.502890
O 0.880780 -2.379712 -1.148713
O -0.520765 -3.945843 0.466387
O 4.501305 -1.870819 2.031046
O 3.259985 0.527383 2.817950
O -5.177343 -2.044979 -1.185991
O -3.918086 -0.197319 -2.899718
C 0.235768 -1.658020 -0.034567
C -0.957232 -2.555674 0.372527
C 1.230219 -1.464995 1.120303
C -2.114443 -2.443534 -0.649882
C 4.869046 0.484536 0.433320
C -4.819021 0.677015 -0.333449
C 5.838079 -0.231422 -0.286473
C -5.549906 0.373713 0.826229
C 4.660391 1.866925 0.304252
C -4.518190 1.983764 -0.746642
C 6.470566 1.892401 -1.373448
C -5.715185 2.799335 1.251479
C 6.641900 0.493909 -1.192820
C -5.999355 1.454789 1.614093
C 5.478697 2.564997 -0.609167
C -4.979083 3.045665 0.062226
C 7.318655 2.653593 -2.374301
C -6.177114 3.948169 2.128024
H -0.136420 -0.673904 -0.377159
H -1.331091 -2.271696 1.370909
H 0.797524 -0.822758 1.909705
H 1.546914 -2.439911 1.536421
H -1.744097 -2.618438 -1.677291
H -2.902951 -3.173390 -0.391951
H 1.783317 -1.989075 -1.276682
H 0.116831 -4.076568 -0.291307
H 5.972408 -1.306089 -0.127893
H -5.776844 -0.664125 1.089507
H 3.903067 2.377697 0.906907
H -3.963505 2.161288 -1.673332
H 7.411931 -0.034559 -1.765628
H -6.578566 1.251027 2.521783
H 5.344389 3.645794 -0.729606
H -4.764767 4.077846 -0.236658
H 6.796647 2.733701 -3.347399
H 7.527666 3.681418 -2.030521
H 8.282452 2.149424 -2.558748
H -7.141106 3.723970 2.616740
H -5.441310 4.147685 2.930939
H -6.293308 4.880326 1.549180


