%chk=000296559.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296559

0 1
S -2.566396 -0.656785 0.661659
O -2.905343 -1.834358 -0.109139
O -2.884889 -0.579892 2.071789
N -3.337377 0.684156 -0.102474
C -3.196313 0.748162 -1.574769
C -3.176554 1.987710 0.580575
C 1.667327 -0.001881 0.245930
C -0.921957 -0.365457 0.478785
C 2.369531 0.703102 1.241562
C 2.350126 -0.511794 -0.874381
C 3.745799 0.897280 1.109508
C 3.726493 -0.310738 -0.994491
C 0.267946 -0.204716 0.375389
C 4.423596 0.392513 -0.005773
H -3.418724 -0.248359 -2.006503
H -2.203489 1.074468 -1.921258
H -3.947894 1.444061 -1.988117
H -3.385214 1.861425 1.661982
H -3.927717 2.700975 0.197202
H -2.181588 2.443320 0.459285
H 1.839040 1.090758 2.112215
H 1.804615 -1.064045 -1.640649
H 4.293030 1.441692 1.879286
H 4.258749 -0.705294 -1.860188
H 5.498704 0.545895 -0.103725


%chk=000296559-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296559

0 1
S -2.668568 -0.665867 0.727242
O -3.024806 -2.011809 -0.103231
O -3.000682 -0.508982 2.306254
N -3.566319 0.756047 -0.149316
C -3.286769 0.712870 -1.604807
C -3.252268 2.041121 0.520433
C 1.728798 0.013445 0.255485
C -0.907314 -0.335513 0.505456
C 2.469604 0.640997 1.299354
C 2.406110 -0.428940 -0.918239
C 3.860895 0.820696 1.165994
C 3.797593 -0.243365 -1.040949
C 0.315153 -0.176187 0.388615
C 4.528290 0.381292 -0.002203
H -3.436336 -0.316226 -1.969899
H -2.267746 1.068324 -1.877293
H -4.032068 1.365197 -2.094600
H -3.379055 1.920160 1.608591
H -3.994436 2.778659 0.165460
H -2.231771 2.425657 0.298045
H 1.947876 0.974636 2.202157
H 1.836119 -0.916486 -1.715760
H 4.425718 1.301026 1.971889
H 4.313526 -0.586939 -1.943710
H 5.609957 0.522385 -0.101270


