%chk=000222598.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222598

0 1
S -5.167036 -0.768375 -0.595016
S -2.701956 -2.363255 -1.285242
O -3.091517 2.420802 0.127252
O -1.222937 -0.259584 1.650233
O 5.590207 0.959527 -0.270814
O 5.563736 -1.204649 -0.287968
N -2.788746 0.215227 -0.584153
N -1.393611 0.311587 -0.589093
N 5.021154 -0.116373 -0.203946
C -5.026584 0.959514 -0.059060
C -3.578296 1.355422 -0.118422
C 0.805631 -0.069513 0.354027
C -0.678110 -0.064241 0.592014
C -3.432477 -1.002908 -0.825182
C 1.500730 1.143533 0.274157
C 1.471276 -1.298064 0.255770
C 3.547763 -0.099866 -0.007670
C 2.885439 1.131799 0.093476
C 2.855430 -1.316751 0.073687
H -5.421729 1.079619 0.975426
H -5.646288 1.622187 -0.702054
H -0.978057 0.155039 -1.520551
H 0.965190 2.093469 0.358430
H 0.915033 -2.236565 0.329575
H 3.454228 2.067295 0.031469
H 3.401525 -2.264575 -0.003545


%chk=000222598-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222598

0 1
S -5.314842 -0.408855 -1.063857
S -2.876675 -1.531214 -2.621272
O -2.963215 2.035633 1.036883
O -1.298089 -0.846106 1.310491
O 5.593490 0.911720 -0.675057
O 5.712556 -1.047046 0.489176
N -2.826201 0.361400 -0.626112
N -1.434097 0.397220 -0.662303
N 5.052474 -0.080141 -0.051750
C -5.002389 0.842770 0.324655
C -3.517613 1.179477 0.322570
C 0.776495 -0.172802 0.223579
C -0.716442 -0.257345 0.362269
C -3.542587 -0.537895 -1.446173
C 1.422031 0.905562 -0.436917
C 1.547730 -1.206266 0.815458
C 3.567207 -0.111150 0.048054
C 2.826772 0.942018 -0.528902
C 2.950903 -1.185378 0.727067
H -5.280152 0.391645 1.290442
H -5.599776 1.749952 0.149375
H -1.017403 0.596068 -1.575964
H 0.838411 1.740910 -0.837545
H 1.028407 -2.011767 1.343364
H 3.353160 1.763000 -1.022109
H 3.569840 -1.971109 1.167379


