%chk=000289346.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289346

0 1
S 1.835879 1.634219 -0.429586
O 2.676348 0.445890 0.454000
O 2.233711 1.415944 -1.799483
O 2.141710 2.882365 0.221140
O -4.126770 -1.566310 -0.981435
N -3.738303 -0.020691 0.689748
N 3.913479 -3.275255 -0.395431
C 0.233080 1.147276 -0.125370
C -2.401865 0.344194 0.380103
C -0.378212 0.176220 -0.933688
C -0.482863 1.715677 0.938900
C -1.686358 -0.227269 -0.691052
C -1.790673 1.326050 1.199693
C 4.038409 0.189244 0.072056
C 4.435531 -1.057952 0.872409
C -4.540318 -0.970552 -0.013728
C -5.912264 -1.135861 0.569173
C 4.144853 -2.290333 0.162718
H 0.175259 -0.268233 -1.771401
H -0.009570 2.480282 1.568732
H -2.154960 -0.986631 -1.330228
H -2.332168 1.777177 2.027517
H 4.093357 0.032707 -1.024887
H 4.650195 1.064187 0.365162
H -4.153866 0.451875 1.497910
H 3.873767 -1.045615 1.844074
H 5.516037 -1.016971 1.142282
H -5.893634 -1.498790 1.606371
H -6.478700 -1.883641 -0.015548
H -6.500491 -0.207904 0.543750


%chk=000289346-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289346

0 1
S 1.982000 1.851939 -0.348744
O 2.925320 0.775089 0.923092
O 2.559114 1.417612 -1.804091
O 2.059637 3.391315 0.139193
O -3.820915 -2.120117 -0.532413
N -3.691028 -0.063523 0.595067
N 2.348075 -2.446715 -0.891155
C 0.255051 1.210854 -0.065361
C -2.349668 0.322596 0.347489
C -0.124534 -0.023409 -0.619666
C -0.606801 2.020440 0.695323
C -1.444687 -0.471237 -0.414335
C -1.920556 1.565634 0.895858
C 4.204999 0.267318 0.412298
C 4.231010 -1.272746 0.582510
C -4.363746 -1.220780 0.168302
C -5.817582 -1.312135 0.621579
C 3.203167 -1.940659 -0.231542
H 0.577295 -0.632652 -1.197460
H -0.260996 2.975881 1.100861
H -1.779717 -1.423316 -0.828054
H -2.616871 2.178774 1.480675
H 4.325496 0.537482 -0.656889
H 5.020803 0.722468 1.002963
H -4.239840 0.591087 1.157025
H 4.066358 -1.528094 1.645278
H 5.231624 -1.652369 0.298064
H -5.948572 -2.231836 1.217343
H -6.463167 -1.407821 -0.268181
H -6.160668 -0.449779 1.218869


