%chk=000229804.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229804

0 1
S -2.826857 -0.685297 0.467575
O 0.839279 0.524364 -0.302091
O -1.711476 1.689860 0.188840
O 4.159097 -0.547130 -0.630638
O 3.172149 1.285528 -1.250437
N 3.191012 0.185770 -0.739492
C -0.219409 -0.191500 0.268276
C 0.200301 -1.430961 0.712894
C -4.327859 0.358131 0.494408
C 1.936301 -0.334955 -0.193300
C 1.597023 -1.525513 0.417069
C -1.514087 0.513268 0.280252
C -5.225337 -0.067980 -0.642447
H -0.393611 -2.193199 1.193590
H -4.812034 0.225074 1.481720
H -4.041691 1.430835 0.413660
H 2.248697 -2.359614 0.628681
H -4.753411 0.078691 -1.625144
H -5.518333 -1.124967 -0.579076
H -6.155555 0.520294 -0.648341


%chk=000229804-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229804

0 1
S -2.896397 -0.717635 1.034982
O 0.756105 0.486129 -0.374537
O -1.902964 1.447527 -0.354025
O 4.175534 -0.550393 -0.571104
O 3.157954 1.383392 -1.289734
N 3.145621 0.222503 -0.732256
C -0.292110 -0.265080 0.198509
C 0.209311 -1.482564 0.677203
C -4.425580 0.354467 0.683435
C 1.895342 -0.297340 -0.230657
C 1.614463 -1.504369 0.403348
C -1.633564 0.344414 0.174904
C -5.060362 0.034442 -0.675559
H -0.373446 -2.262083 1.163540
H -5.100833 0.151916 1.530487
H -4.072884 1.398278 0.729308
H 2.333662 -2.286344 0.630705
H -4.358278 0.250349 -1.498350
H -5.369817 -1.022684 -0.743180
H -5.957558 0.665775 -0.821022


