%chk=000257218.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257218

0 1
S 0.946888 0.494313 -1.213146
O 0.027339 1.530765 1.720348
O -1.236958 2.546680 0.190557
O 2.898138 -1.018511 1.469017
O 3.445356 -1.424359 -0.664209
C -0.553064 0.188155 -0.173928
C -1.673174 0.009246 -1.203026
C -3.109849 -0.262500 -0.685939
C -0.336850 -0.978508 0.785222
C -3.312957 -1.704426 -0.209333
C -3.567051 0.724802 0.389050
C -0.683446 1.530751 0.530411
C 0.018216 -2.291421 0.095744
C 2.313756 0.665872 -0.048875
C 2.941205 -0.673244 0.132072
H -1.726960 0.925324 -1.838001
H -1.399455 -0.820988 -1.891010
H -3.773879 -0.113020 -1.581814
H -1.268117 -1.120480 1.383318
H 0.451759 -0.724317 1.531797
H -4.369149 -1.899345 0.009520
H -2.996694 -2.431873 -0.963825
H -2.749679 -1.912533 0.710298
H -3.048257 0.577597 1.341098
H -3.399768 1.766226 0.076982
H -4.639031 0.617900 0.590850
H 0.141252 -3.093928 0.833020
H -0.759519 -2.612237 -0.608233
H 0.953434 -2.233463 -0.476856
H 1.989576 1.106893 0.927986
H 3.041837 1.385884 -0.488362
H -0.031069 2.403156 2.194933
H 3.300472 -1.908912 1.650833


%chk=000257218-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257218

0 1
S 1.028447 0.397383 -1.266689
O 0.049296 1.651419 1.760095
O -1.241898 2.590306 0.086581
O 2.983640 -1.276818 1.300314
O 4.167295 -1.021112 -0.682593
C -0.564797 0.196054 -0.110129
C -1.693717 0.019196 -1.167649
C -3.168320 -0.252434 -0.699703
C -0.361250 -0.959072 0.897966
C -3.470491 -1.731075 -0.346222
C -3.686949 0.686736 0.416415
C -0.659386 1.581393 0.539793
C -0.088563 -2.339144 0.266986
C 2.470508 0.655648 -0.045962
C 3.298886 -0.598740 0.110870
H -1.702398 0.944229 -1.774245
H -1.398076 -0.807239 -1.842401
H -3.767409 -0.026323 -1.607736
H -1.268703 -1.006997 1.533256
H 0.469648 -0.705602 1.577299
H -4.561077 -1.870334 -0.222978
H -3.133716 -2.416453 -1.146318
H -2.990071 -2.042462 0.598231
H -3.159201 0.516576 1.375253
H -3.563254 1.748417 0.146102
H -4.760703 0.492928 0.597809
H 0.096396 -3.080479 1.065395
H -0.933430 -2.701832 -0.340531
H 0.804282 -2.305112 -0.381095
H 2.052756 0.996792 0.912533
H 3.089515 1.442110 -0.503323
H -0.032822 2.579432 2.113138
H 3.529865 -2.107889 1.356037


