%chk=000239049.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239049

0 1
S -4.078968 -0.820562 0.014200
O 2.565601 -0.325592 -0.421804
O 0.565196 -1.785369 -1.326738
O 2.186598 1.399887 0.997519
N -1.517120 -1.242566 -0.637106
N -1.947558 0.580077 0.860143
C 0.341287 0.100570 0.198042
C -0.052618 -1.014503 -0.637797
C -0.597962 0.842020 0.900870
C 1.756509 0.482041 0.327277
C -2.364458 -0.447374 0.097700
C 4.009414 -0.074793 -0.374856
C 4.584009 -0.604964 0.921429
C -4.858296 0.400034 1.075233
H -1.864816 -2.021344 -1.211730
H -0.295159 1.693408 1.537580
H 4.335181 -0.645123 -1.265003
H 4.182975 1.007123 -0.509405
H 5.679636 -0.581476 0.914701
H 4.244138 -0.006448 1.780388
H 4.271280 -1.641607 1.104240
H -4.495789 0.337846 2.113232
H -5.942128 0.219120 1.066309
H -4.666551 1.428895 0.732574


%chk=000239049-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239049

0 1
S -4.201826 -0.863655 0.016607
O 2.614130 -0.326089 -0.423994
O 0.522294 -1.983002 -1.287520
O 2.092377 1.427044 1.023500
N -1.580347 -1.293308 -0.575471
N -2.005239 0.580733 0.824601
C 0.313446 0.022316 0.164031
C -0.130107 -1.139998 -0.621889
C -0.641699 0.798385 0.832540
C 1.733889 0.448859 0.311962
C -2.435128 -0.466211 0.113940
C 4.063630 0.033587 -0.317334
C 4.699184 -0.651755 0.895468
C -4.901217 0.516749 1.088684
H -1.931018 -2.094910 -1.114014
H -0.296336 1.657058 1.416902
H 4.482871 -0.332902 -1.267426
H 4.152438 1.132298 -0.252622
H 5.788317 -0.459722 0.903226
H 4.274074 -0.261115 1.835284
H 4.540172 -1.742911 0.854757
H -4.479914 0.439661 2.099422
H -5.989404 0.351173 1.092175
H -4.644186 1.487016 0.644170


