%chk=000228198.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228198

0 1
S -1.721431 3.513104 -0.383712
S 1.717706 3.139070 -1.581111
S 0.179023 3.548613 2.035556
S -0.187864 1.841839 -3.618760
S -1.283188 5.483165 -0.629367
S 1.292710 4.918628 -2.467632
S 0.012966 7.348582 -2.196922
O -0.960058 1.513938 1.115556
O 0.940632 0.649180 -1.724649
C -1.731596 -0.673857 0.830249
C 1.698501 -1.019846 -0.274444
C -2.710646 -1.640350 0.153565
C 2.674172 -1.456954 0.824438
C -1.833863 0.718497 0.219601
C 1.811114 0.477032 -0.536556
C -2.591645 -3.046979 0.733077
C 2.544742 -2.948347 1.120399
C -0.799078 2.818231 0.971752
C 0.788122 1.816118 -2.326990
C 0.007035 5.808142 -1.731776
H -0.683970 -1.052095 0.731003
H -1.921086 -0.623000 1.922329
H 0.649015 -1.272780 0.017143
H 1.884517 -1.583230 -1.212077
H -3.750198 -1.274509 0.272985
H -2.521238 -1.668935 -0.939015
H 3.715455 -1.225587 0.522825
H 2.488475 -0.874674 1.750120
H -2.854610 1.132588 0.267624
H -1.414239 0.770707 -0.802485
H 2.834416 0.788567 -0.803957
H 1.394069 1.089131 0.284956
H -2.803209 -3.062838 1.808861
H -3.299668 -3.732612 0.251793
H -1.587686 -3.462976 0.589608
H 2.752400 -3.558499 0.233315
H 3.250366 -3.257838 1.900997
H 1.538837 -3.208429 1.469801


%chk=000228198-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228198

0 1
S -1.622654 3.533692 -0.119584
S 1.589931 2.978006 -1.791739
S 0.713739 3.129616 1.979295
S -0.747422 1.481110 -3.316375
S -0.616288 5.607397 -0.126298
S 0.619632 4.700568 -2.979076
S 0.022434 7.525674 -2.297414
O -0.964392 1.234116 1.160096
O 0.918599 0.359001 -1.570719
C -2.201856 -0.808304 0.675342
C 2.180579 -1.083786 -0.066177
C -3.373142 -1.481280 -0.081610
C 3.332428 -1.216621 0.960345
C -2.124609 0.682727 0.358319
C 2.065371 0.348127 -0.582165
C -3.463669 -2.992985 0.217293
C 3.465420 -2.657511 1.497929
C -0.567436 2.543652 1.076358
C 0.528576 1.493800 -2.233568
C 0.008034 5.908135 -1.789797
H -1.248369 -1.286774 0.382619
H -2.326347 -0.947909 1.765865
H 1.224769 -1.372540 0.410396
H 2.350611 -1.770553 -0.916745
H -4.327744 -0.991850 0.199035
H -3.245327 -1.326129 -1.171319
H 4.288064 -0.909035 0.489448
H 3.156139 -0.520068 1.803908
H -3.039643 1.219954 0.674264
H -1.925482 0.860369 -0.715836
H 2.980520 0.666303 -1.118293
H 1.830764 1.059053 0.232845
H -3.616807 -3.177353 1.297082
H -4.304858 -3.457403 -0.327931
H -2.536284 -3.513272 -0.086419
H 3.666990 -3.371409 0.677535
H 4.292161 -2.736717 2.226420
H 2.536570 -2.979007 2.004772


