%chk=000274291.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274291

0 1
S 3.336202 0.520480 0.008111
O -1.124301 1.465701 -0.006305
N -1.402388 -0.828267 0.000427
N 1.450891 -1.135225 0.002485
N 2.696394 -1.129198 0.005868
C -2.891350 -0.914021 -0.003243
C -0.658349 0.336271 -0.001910
C -3.608872 0.425975 -0.014230
C 0.832066 0.150336 0.002094
C 1.742819 1.177308 0.005358
H -3.189041 -1.509116 -0.900113
H -3.194174 -1.497248 0.899696
H -0.927278 -1.734061 0.003717
H -3.341327 1.043415 0.856753
H -3.336116 1.031886 -0.891604
H -4.695391 0.292623 -0.016580
H 1.518714 2.238641 0.005476


%chk=000274291-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000274291

0 1
S 3.484936 0.525984 -0.220450
O -0.779025 1.089150 1.630032
N -1.440384 -0.513601 0.045264
N 1.187629 -0.687284 -0.930810
N 2.373249 -0.775819 -1.372390
C -2.865576 -0.521747 0.414033
C -0.515035 0.296590 0.672146
C -3.770698 0.007731 -0.718079
C 0.875777 0.173966 0.132036
C 1.988901 0.874308 0.603244
H -3.162273 -1.551975 0.691387
H -2.958131 0.110353 1.313296
H -1.117039 -1.104189 -0.726443
H -3.512030 1.051160 -0.967770
H -3.674383 -0.603126 -1.634855
H -4.829024 -0.021827 -0.401376
H 1.921606 1.585827 1.426734


