%chk=000223287.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223287

0 1
S -1.564089 2.570609 0.064898
O -1.745783 2.431813 1.493575
O -2.680281 2.377804 -0.837501
N -0.359810 1.437240 -0.414497
C -0.037723 0.305651 0.494138
C 1.464632 0.080293 0.374607
C -0.827921 -0.969586 0.222474
C 2.008867 -0.550910 -0.753577
C -0.363092 -2.173930 0.778356
C 2.311878 0.533646 1.395212
C -2.019104 -0.970190 -0.513633
C -0.812311 4.104669 -0.282636
C 3.390883 -0.727753 -0.856828
C -1.071725 -3.360879 0.586108
C 3.693980 0.352149 1.288111
C -2.726364 -2.162760 -0.704874
C 4.235618 -0.277235 0.163213
C -2.255627 -3.359367 -0.159899
H -0.289487 0.619390 1.555379
H -0.324940 1.155672 -1.402645
H 1.352344 -0.912869 -1.543558
H 0.557619 -2.185123 1.362030
H 1.897449 1.029403 2.272070
H -2.429242 -0.049794 -0.937077
H -1.233147 4.599546 -1.171056
H -0.922616 4.825298 0.543499
H 0.272920 4.035719 -0.459353
H 3.810460 -1.219528 -1.732888
H -0.702881 -4.288954 1.019568
H 4.349130 0.702864 2.083847
H -3.652709 -2.150823 -1.278162
H 5.311483 -0.417468 0.081661
H -2.808213 -4.284396 -0.309661


%chk=000223287-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223287

0 1
S -1.610567 2.573121 0.064305
O -1.658724 2.417195 1.686435
O -2.961402 2.450278 -0.847646
N -0.274912 1.380176 -0.555496
C 0.025370 0.263015 0.402428
C 1.542192 0.055789 0.358090
C -0.813853 -1.008877 0.170704
C 2.158130 -0.574127 -0.753793
C -0.314178 -2.276006 0.570346
C 2.356420 0.537576 1.411199
C -2.126221 -0.933931 -0.364375
C -0.775086 4.227207 -0.343796
C 3.561173 -0.713397 -0.812538
C -1.098138 -3.441118 0.424768
C 3.761825 0.393998 1.358466
C -2.908794 -2.102030 -0.512653
C 4.368634 -0.229440 0.244282
C -2.399089 -3.360334 -0.122710
H -0.238873 0.660860 1.406933
H -0.628170 1.036955 -1.471762
H 1.537405 -0.965988 -1.568406
H 0.692896 -2.351629 0.994306
H 1.888334 1.025179 2.275158
H -2.569147 0.028877 -0.650411
H -0.662417 4.260635 -1.435508
H -1.453909 5.004582 0.033660
H 0.190668 4.212812 0.176805
H 4.025550 -1.200079 -1.677580
H -0.693242 -4.409952 0.738467
H 4.379820 0.765233 2.183628
H -3.920772 -2.022467 -0.925130
H 5.457878 -0.340377 0.200364
H -3.008603 -4.263534 -0.237637


