%chk=000257216.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257216

0 1
S -0.788724 0.758272 0.383936
O 3.001023 0.783375 0.676511
O -2.813268 -1.924568 -0.141448
N 1.398775 0.083284 2.095423
N -3.951244 -0.124285 0.637497
C 0.847465 0.349845 -0.344289
C 0.855776 -1.068175 -0.976844
C 1.173138 1.428215 -1.389741
C 0.454810 -2.173211 0.000996
C 2.230959 -1.384353 -1.579711
C 1.841179 0.429303 0.823053
C 1.177161 2.853971 -0.848774
C -2.012662 0.236274 -0.841359
C -2.920968 -0.711458 -0.098253
H 0.103452 -1.062117 -1.813459
H 2.186779 1.213265 -1.805800
H 0.471188 1.349514 -2.242369
H 1.152163 -2.271920 0.837815
H 0.435083 -3.147448 -0.507042
H -0.559066 -2.037611 0.405336
H 2.482360 -0.716138 -2.410865
H 3.036566 -1.285503 -0.837914
H 2.268037 -2.410256 -1.962997
H 1.911427 2.970897 -0.038034
H 1.458050 3.565096 -1.634797
H 0.201359 3.166434 -0.460922
H -2.530855 1.117691 -1.262927
H -1.542104 -0.291287 -1.702934
H 2.056457 0.111417 2.861741
H 0.503486 -0.334408 2.293218
H -4.536471 -0.710568 1.215620
H -3.988631 0.860651 0.832634


%chk=000257216-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257216

0 1
S -0.890032 0.941463 0.697197
O 3.120969 0.331886 0.547470
O -3.741555 -0.308638 -2.004920
N 1.576276 0.523921 2.251825
N -3.024245 -1.208304 0.023404
C 0.776753 0.330625 -0.145737
C 0.595122 -1.167970 -0.612015
C 1.141160 1.270925 -1.326281
C 0.479492 -2.154043 0.575597
C 1.720734 -1.645585 -1.568946
C 1.909570 0.410907 0.919362
C 1.215184 2.772984 -0.989318
C -2.123811 0.978116 -0.736818
C -3.022389 -0.250224 -0.963336
H -0.357884 -1.195621 -1.178772
H 2.134760 0.943485 -1.681534
H 0.436038 1.095146 -2.162690
H 1.457145 -2.286271 1.074105
H 0.149930 -3.143778 0.211555
H -0.244418 -1.806869 1.335223
H 1.707823 -1.105812 -2.531146
H 2.714365 -1.511130 -1.107651
H 1.577468 -2.719723 -1.788058
H 1.968087 2.962597 -0.203276
H 1.516145 3.345579 -1.885353
H 0.246381 3.165442 -0.634286
H -2.779305 1.841817 -0.529181
H -1.586447 1.195623 -1.672588
H 2.338666 0.559005 2.929268
H 0.612001 0.599908 2.575875
H -3.630574 -2.021365 -0.076568
H -2.390710 -1.119896 0.820893


