%chk=000238435.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238435

0 1
S 3.329608 0.997773 -1.173150
O -1.288555 0.585376 2.592553
O 0.558043 1.405731 -0.313016
N -4.270236 -0.554217 -1.328939
C 0.258469 -0.486553 1.130474
C -1.104238 0.065350 1.521964
C 1.032681 0.406683 0.185437
C -2.200006 -0.151236 0.517447
C 2.405193 -0.006003 -0.109858
C 3.151622 -1.081721 0.304283
C -3.145663 -1.160151 0.734000
C -2.293234 0.658531 -0.616721
C 4.475349 -1.085217 -0.248490
C 4.717940 -0.016864 -1.071155
C -4.165018 -1.328869 -0.217868
C -3.348061 0.424276 -1.516051
H 0.854428 -0.641786 2.060256
H 0.145183 -1.494681 0.676379
H 2.806590 -1.858466 0.974148
H -3.106239 -1.789548 1.619983
H -1.562661 1.454517 -0.799485
H 5.191602 -1.864275 -0.022211
H 5.628431 0.208724 -1.604377
H -4.931193 -2.104059 -0.097623
H -3.467735 1.034282 -2.419978


%chk=000238435-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238435

0 1
S 3.361808 0.999249 -1.342349
O -0.196791 -1.454392 1.811099
O 0.762057 -0.276086 -2.366411
N -4.367801 0.674450 -0.207709
C 0.290945 -1.836397 -0.540080
C -0.579394 -1.310331 0.613289
C 1.120212 -0.725585 -1.235111
C -1.879536 -0.629249 0.293322
C 2.309707 -0.241699 -0.535578
C 2.801866 -0.570137 0.733962
C -2.752718 -0.286090 1.359980
C -2.272437 -0.297959 -1.030206
C 3.997489 0.137263 1.084337
C 4.427831 1.006687 0.085566
C -3.973649 0.352725 1.064237
C -3.512988 0.352367 -1.223783
H 0.965806 -2.597632 -0.117014
H -0.333029 -2.297767 -1.322423
H 2.295285 -1.274118 1.399602
H -2.465956 -0.523118 2.388856
H -1.628686 -0.507855 -1.890176
H 4.519494 0.013076 2.035478
H 5.302519 1.655855 0.088282
H -4.674727 0.624264 1.860837
H -3.845007 0.630078 -2.230006


