%chk=000230554.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230554

0 1
S 2.387428 -0.604603 0.110166
O 2.796329 -1.133460 1.397405
O 2.971689 -1.166922 -1.091268
O -3.699871 -1.498107 -0.277095
N -2.624964 -0.773484 -0.789649
C 0.146652 0.796932 0.185751
C 0.626876 -0.643570 -0.010075
C 1.281175 1.755239 -0.264728
C 2.628762 1.153377 0.112705
C -1.148356 1.096771 -0.591947
C -2.305840 0.271625 -0.078101
C -2.982506 0.729440 1.173077
H -0.047273 0.964146 1.276064
H 0.158988 -1.326171 0.725556
H 0.284383 -1.058428 -0.982497
H 1.147883 2.751392 0.196400
H 1.234478 1.925520 -1.359663
H 3.425124 1.468556 -0.587625
H 2.977392 1.514917 1.099373
H -0.991656 0.911410 -1.678396
H -1.404060 2.173242 -0.509805
H -3.590731 -0.074997 1.621700
H -2.269224 1.063983 1.936455
H -3.668593 1.564050 0.966808
H -3.791385 -2.254159 -0.947011


%chk=000230554-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230554

0 1
S 2.523956 -0.633017 0.227297
O 2.836654 -1.157385 1.746362
O 3.304282 -1.258106 -1.068506
O -3.927664 -1.385840 -0.296339
N -2.794874 -0.648618 -0.880984
C 0.152098 0.806368 0.109699
C 0.592607 -0.649474 -0.096764
C 1.281787 1.744783 -0.427996
C 2.624525 1.328198 0.174621
C -1.197312 1.105050 -0.603820
C -2.367332 0.294682 -0.067434
C -2.942007 0.621802 1.291429
H 0.039977 0.995929 1.196190
H 0.193617 -1.374138 0.625437
H 0.488585 -1.000361 -1.135136
H 1.051937 2.794252 -0.167001
H 1.321655 1.674146 -1.531810
H 3.511781 1.544862 -0.435787
H 2.760743 1.613938 1.228627
H -1.087985 0.902169 -1.685363
H -1.420227 2.184932 -0.483249
H -3.540322 -0.215092 1.682623
H -2.140689 0.869639 2.010401
H -3.604267 1.506802 1.219877
H -4.118827 -2.058820 -0.998776


