%chk=000285224.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285224

0 1
S 3.788729 -0.885565 -0.846768
O 1.185406 -0.937339 -0.805836
O -4.692426 0.669031 0.879782
O -5.211202 -0.921508 -0.644640
O 6.496442 1.230280 0.893755
O 6.552411 -0.410569 -0.528867
N 2.279179 0.724141 0.597860
N 5.970848 0.391653 0.185391
C -2.893876 -0.390326 -0.195641
C -0.172474 -0.646085 -0.508113
C -2.384565 -1.357930 -1.084645
C -2.027091 0.440080 0.527679
C -1.010696 -1.496002 -1.250434
C -0.640764 0.318889 0.376856
C -4.366211 -0.283941 -0.057232
C -6.114554 0.927182 1.123544
C 2.222669 -0.289418 -0.278001
C -6.676745 1.788662 0.013583
C 4.535672 0.313384 0.166085
C 3.602464 1.069185 0.851958
H -3.079493 -1.996917 -1.641419
H -2.439235 1.187723 1.214834
H -0.586086 -2.234620 -1.929912
H 0.031304 0.970494 0.944286
H -6.635726 -0.042382 1.217551
H -6.062130 1.445434 2.098551
H -7.693772 2.127628 0.244738
H -6.059073 2.678918 -0.161466
H -6.723361 1.233963 -0.936219
H 3.818156 1.883055 1.549340


%chk=000285224-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000285224

0 1
S 3.920537 -0.975037 -0.925748
O 1.223401 -0.994336 -0.846226
O -4.731642 0.724095 0.883076
O -5.238862 -1.003832 -0.604432
O 6.474166 1.415373 1.043718
O 6.802156 -0.301679 -0.451686
N 2.334227 0.658619 0.537110
N 6.046848 0.482719 0.253473
C -2.911952 -0.410276 -0.182486
C -0.154466 -0.716749 -0.555055
C -2.421050 -1.413140 -1.059644
C -2.000559 0.433017 0.500512
C -1.038405 -1.570886 -1.249870
C -0.608201 0.290973 0.323738
C -4.390317 -0.286752 -0.016901
C -6.193874 0.949496 1.106088
C 2.298884 -0.351610 -0.331726
C -6.764966 1.896399 0.047193
C 4.624538 0.301495 0.148500
C 3.644008 1.029559 0.810568
H -3.138206 -2.055317 -1.579868
H -2.388400 1.201953 1.173544
H -0.632739 -2.334661 -1.918628
H 0.101141 0.934094 0.845576
H -6.704385 -0.029249 1.087918
H -6.234492 1.383954 2.117640
H -7.820301 2.125515 0.285089
H -6.203419 2.846082 0.023295
H -6.730887 1.433526 -0.952974
H 3.851017 1.843754 1.504805


