%chk=000209412.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209412

0 1
S -2.067772 1.296641 -0.948680
O -0.779045 0.764509 -1.825315
O -2.568275 -0.275438 -0.473294
O -1.688838 1.941024 0.298970
C 1.310314 0.481287 -0.596720
C 2.650377 -0.187103 -0.965846
C 1.067167 0.516276 0.924248
C 3.857201 0.628937 -0.484679
C 0.161471 -0.216639 -1.348199
C 5.181183 -0.033751 -0.890782
C 0.957083 -0.857511 1.579635
C 6.385666 0.772445 -0.409820
C -2.890207 -0.492295 0.903583
C -4.231232 -0.031997 1.194681
C -5.348268 0.349276 1.435502
H 1.339913 1.544441 -0.955948
H 2.710853 -0.313533 -2.064955
H 2.691911 -1.207449 -0.538882
H 0.145027 1.106281 1.129684
H 1.886530 1.088343 1.404518
H 3.818586 0.746148 0.616337
H 3.808909 1.655103 -0.897246
H -0.364632 -0.973109 -0.738060
H 0.495462 -0.686544 -2.294109
H 5.230563 -1.060515 -0.478601
H 5.223886 -0.147301 -1.991722
H 1.888501 -1.427099 1.477081
H 0.746979 -0.764136 2.651067
H 0.154321 -1.456959 1.134913
H 7.326124 0.293538 -0.704177
H 6.387547 1.784765 -0.829918
H 6.395407 0.871695 0.681597
H -2.802979 -1.598806 1.004478
H -2.136185 0.005115 1.559559
H -6.305148 0.677159 1.646699


%chk=000209412-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209412

0 1
S -2.373802 1.325679 0.594173
O -0.829680 1.646685 -0.351175
O -3.322898 0.315490 -0.720346
O -2.017786 0.228250 1.733458
C 1.563293 1.093404 -0.322448
C 2.569055 -0.058773 -0.610509
C 1.810202 1.831712 1.022604
C 4.048691 0.386350 -0.647161
C 0.134709 0.517235 -0.417856
C 5.006192 -0.759202 -1.049981
C 1.779756 0.941408 2.286625
C 6.487610 -0.324620 -1.066941
C -3.615616 -1.077265 -0.303459
C -5.035314 -1.257904 0.028280
C -6.225224 -1.428751 0.301676
H 1.668167 1.842126 -1.135724
H 2.314568 -0.517998 -1.589081
H 2.448578 -0.859895 0.147780
H 1.048781 2.628963 1.118791
H 2.788271 2.346973 0.963770
H 4.351927 0.774002 0.345921
H 4.163635 1.228830 -1.360933
H -0.060251 -0.189772 0.414835
H -0.025290 0.003588 -1.384465
H 4.876376 -1.606311 -0.345457
H 4.718923 -1.140960 -2.051009
H 2.557795 0.156367 2.254594
H 1.964370 1.552996 3.188638
H 0.799779 0.447971 2.422294
H 7.151850 -1.160519 -1.353523
H 6.651061 0.499331 -1.786952
H 6.806679 0.033980 -0.070013
H -3.323023 -1.709032 -1.162109
H -2.979413 -1.347826 0.569276
H -7.263571 -1.569714 0.542026


