%chk=000256166.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256166

0 1
S -4.243512 -0.042340 0.083327
O 3.766226 0.910635 -0.004259
O -4.705199 0.253522 1.426357
O -4.908260 0.520353 -1.076085
N 1.576558 0.961365 -0.321855
N -4.410931 -1.751791 -0.083793
C 3.826479 -1.992014 0.065368
C 5.080627 -1.163981 0.356552
C 2.575545 -1.219388 0.490560
C 4.978031 0.178655 -0.353377
C 2.578267 0.214258 0.024161
C 0.206699 0.644150 -0.200602
C -2.552711 0.226350 -0.023024
C -0.391619 0.419480 1.059195
C -0.585163 0.665750 -1.370877
C -1.767661 0.221913 1.136356
C -1.956826 0.462742 -1.270621
H 3.771975 -2.241441 -1.013452
H 3.870205 -2.961855 0.598350
H 5.194724 -1.013350 1.449382
H 5.991446 -1.701525 0.028751
H 2.490890 -1.216039 1.601217
H 1.663956 -1.741439 0.128909
H 5.750170 0.904452 -0.033131
H 4.979825 0.082223 -1.453889
H 0.212861 0.436176 1.962419
H -0.117726 0.865766 -2.334574
H -2.238359 0.067269 2.114890
H -2.577292 0.495615 -2.174465
H -4.866503 -2.103437 -0.922819
H -4.753521 -2.274471 0.719027


%chk=000256166-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256166

0 1
S -4.311019 -0.149813 0.119678
O 3.862755 0.943688 -0.074727
O -4.766062 0.165387 1.653678
O -5.057643 0.477501 -1.186979
N 1.611450 1.072193 -0.388282
N -4.418301 -1.988302 -0.068417
C 3.769133 -1.978376 0.029562
C 5.059073 -1.230389 0.422332
C 2.540067 -1.131282 0.434747
C 5.093993 0.125367 -0.290879
C 2.613229 0.320077 -0.046680
C 0.254876 0.734985 -0.246126
C -2.483975 0.206981 -0.027042
C -0.334031 0.488333 1.031125
C -0.578578 0.753213 -1.403762
C -1.711918 0.223472 1.146526
C -1.953879 0.475799 -1.301824
H 3.761147 -2.159412 -1.063259
H 3.715852 -2.965174 0.522894
H 5.093623 -1.085459 1.519258
H 5.959415 -1.805208 0.134756
H 2.472924 -1.112352 1.541428
H 1.600327 -1.578426 0.067193
H 5.904422 0.776039 0.072876
H 5.203256 -0.010532 -1.384951
H 0.290137 0.534370 1.929803
H -0.128075 0.993236 -2.371156
H -2.182273 0.055514 2.120667
H -2.607079 0.496094 -2.179963
H -4.996018 -2.178775 -0.905223
H -4.837624 -2.361144 0.800747


