%chk=000236951.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236951

0 1
I 5.244320 1.877831 0.539240
S -0.954009 -1.514268 0.835647
O -2.320025 1.486751 1.184687
O -1.932602 0.877370 -0.940727
N -4.633041 -0.337549 -0.344713
C -3.426147 -0.492192 0.497049
C -2.672507 -1.818582 0.335309
C -0.054011 -1.453191 -0.751586
C 1.186247 -0.681604 -0.444747
C 2.315267 -1.327288 0.084089
C 1.224157 0.702405 -0.686471
C -2.479575 0.651713 0.115350
C 3.474187 -0.596978 0.367330
C 2.381106 1.433795 -0.407456
C 3.491222 0.772875 0.116077
H -3.734877 -0.352395 1.574878
H -3.092248 -2.602128 0.995223
H -2.730466 -2.214574 -0.693680
H -0.668985 -0.947664 -1.529988
H 0.156991 -2.475946 -1.113658
H 2.293397 -2.398546 0.281200
H 0.340618 1.206360 -1.092705
H -5.355102 -0.999489 -0.079803
H -4.426576 -0.465726 -1.332476
H 4.348000 -1.103751 0.780212
H 2.406195 2.507455 -0.601152
H -1.699135 2.243216 1.000071


%chk=000236951-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236951

0 1
I 5.691428 1.671622 0.584638
S -0.895318 -1.624852 0.926621
O -3.195439 1.788211 0.752139
O -2.330031 0.785588 -1.156453
N -4.888000 -0.804417 0.039590
C -3.519169 -0.605614 0.548934
C -2.645881 -1.828877 0.224645
C 0.093537 -1.363046 -0.706116
C 1.395825 -0.664483 -0.408955
C 2.557594 -1.399695 -0.062226
C 1.480191 0.750875 -0.463027
C -2.907067 0.676250 -0.046501
C 3.777997 -0.746684 0.224167
C 2.692025 1.420882 -0.184562
C 3.832972 0.662156 0.158806
H -3.574799 -0.473891 1.642092
H -3.094490 -2.726534 0.675965
H -2.558661 -1.976454 -0.865870
H -0.557549 -0.752719 -1.352117
H 0.249718 -2.360912 -1.146782
H 2.513375 -2.493999 -0.011758
H 0.589721 1.331551 -0.730664
H -5.605223 -0.210097 0.462220
H -4.963585 -0.877142 -0.979299
H 4.664886 -1.328778 0.489774
H 2.742879 2.512228 -0.237011
H -2.864536 2.616728 0.308951


