%chk=000252862.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252862

0 1
S 3.600011 0.719543 0.187598
S 4.982606 -0.613323 -2.174795
O 6.176941 0.599957 -0.326267
C -2.863753 -0.198992 -0.526566
C -4.123374 0.185488 0.261284
C -1.593005 0.315427 0.163301
C -5.394324 -0.328826 -0.428278
C -0.334967 -0.070091 -0.625906
C -6.654019 0.055535 0.359130
C 0.936882 0.446305 0.066924
C -7.926252 -0.458237 -0.329688
C 2.171659 0.053810 -0.731514
C -9.183358 -0.078618 0.449782
C 4.994036 0.233896 -0.782712
C 6.320954 1.373766 0.928856
C 7.820074 1.548709 1.031932
H -2.925335 0.206713 -1.554990
H -2.812561 -1.299274 -0.639750
H -4.176281 1.285569 0.374252
H -4.063468 -0.220437 1.289573
H -1.533591 -0.090779 1.191732
H -1.646360 1.415716 0.276082
H -5.455191 0.076837 -1.456613
H -5.342474 -1.428958 -0.541246
H -0.396575 0.336084 -1.654595
H -0.283712 -1.170842 -0.738562
H -6.595402 -0.349685 1.387549
H -6.707948 1.155277 0.472891
H 0.986868 0.037212 1.097566
H 0.873456 1.548787 0.179143
H -7.987656 -0.051820 -1.358224
H -7.874898 -1.558917 -0.442391
H 2.269596 -1.045628 -0.837319
H 2.155787 0.470867 -1.758820
H -9.285542 1.008200 0.546707
H -10.085636 -0.449550 -0.049144
H -9.172661 -0.497879 1.462263
H 5.898593 0.772195 1.752160
H 5.781987 2.328994 0.805781
H 8.095533 2.114291 1.930189
H 8.337171 0.578235 1.069132
H 8.224588 2.080442 0.157753


%chk=000252862-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252862

0 1
S 3.727210 0.789266 0.294441
S 4.869451 -0.693316 -2.227961
O 6.347501 0.550080 -0.405891
C -2.908181 -0.182956 -0.498921
C -4.206098 0.175704 0.259336
C -1.631255 0.331187 0.203297
C -5.485772 -0.335590 -0.440200
C -0.332750 -0.028682 -0.554263
C -6.782909 0.021776 0.320083
C 0.936861 0.495565 0.160566
C -8.063613 -0.488471 -0.379418
C 2.207304 0.118451 -0.618357
C -9.354133 -0.129051 0.388707
C 5.079253 0.199323 -0.815882
C 6.574993 1.348104 0.847311
C 8.082913 1.540883 0.958087
H -2.956423 0.235675 -1.525924
H -2.844825 -1.285119 -0.615471
H -4.268992 1.277927 0.377021
H -4.158115 -0.243496 1.286298
H -1.584605 -0.087225 1.230359
H -1.695359 1.433375 0.318191
H -5.535411 0.084693 -1.466658
H -5.423136 -1.437707 -0.559258
H -0.378902 0.389363 -1.580834
H -0.266539 -1.130404 -0.666321
H -6.735152 -0.399335 1.346369
H -6.846932 1.123774 0.439982
H 0.981223 0.074817 1.184424
H 0.869273 1.596369 0.265859
H -8.111508 -0.066133 -1.403971
H -7.998103 -1.589196 -0.500244
H 2.344801 -0.971882 -0.705043
H 2.228201 0.552666 -1.631377
H -9.458135 0.967235 0.496735
H -10.254499 -0.504483 -0.131497
H -9.343783 -0.565635 1.405336
H 6.161093 0.780977 1.702457
H 6.034922 2.309089 0.752229
H 8.316833 2.123821 1.867698
H 8.598155 0.568338 1.023824
H 8.473540 2.086220 0.083082


