%chk=000235529.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235529

0 1
S 1.351400 0.270330 0.736491
O 1.418224 1.575910 1.373105
O 1.906958 -0.871919 1.444046
N 2.183540 0.350365 -0.786893
N -3.489779 1.884381 0.249856
C -0.289901 -0.033755 0.266173
C -0.684702 -1.251863 -0.295703
C -1.216023 0.992891 0.484132
C -2.042496 -1.427837 -0.647295
C -2.562473 0.809494 0.133847
C 0.285434 -2.356153 -0.534289
C 1.937628 1.613729 -1.528205
C 3.625668 0.007202 -0.697754
C -2.971385 -0.419517 -0.438745
H -0.886653 1.939061 0.929858
H -2.361587 -2.371694 -1.089260
H 0.861500 1.695315 -1.762917
H 2.473244 1.597986 -2.492353
H 2.247620 2.522143 -0.981422
H 3.752002 -0.916546 -0.098740
H 4.251191 0.796000 -0.248978
H 4.014046 -0.204228 -1.708481
H 0.883113 -2.582615 0.372158
H -0.191527 -3.294677 -0.839650
H 1.011758 -2.089367 -1.321164
H -4.012585 -0.567426 -0.722737
H -4.456115 1.603651 0.354238
H -3.245001 2.585240 0.938780


%chk=000235529-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235529

0 1
S 1.389433 0.323052 0.783265
O 1.383662 1.821831 1.448122
O 2.036649 -0.916637 1.621443
N 2.292214 0.312317 -0.928880
N -3.597411 1.802943 0.456923
C -0.390685 -0.055047 0.244110
C -0.722187 -1.304576 -0.327733
C -1.291387 0.983004 0.518905
C -2.102082 -1.449374 -0.638213
C -2.665769 0.798800 0.199284
C 0.274233 -2.413012 -0.603506
C 2.039600 1.615736 -1.598453
C 3.734638 0.025289 -0.702936
C -3.052214 -0.440110 -0.389559
H -0.921602 1.904206 0.984688
H -2.433741 -2.392372 -1.088490
H 0.953327 1.779038 -1.700679
H 2.471978 1.545276 -2.613430
H 2.492545 2.482177 -1.072754
H 3.823026 -0.800460 0.023328
H 4.314149 0.898981 -0.336094
H 4.155024 -0.308496 -1.669409
H 0.766009 -2.748683 0.326583
H -0.228978 -3.275408 -1.071861
H 1.075425 -2.058272 -1.277193
H -4.104240 -0.611688 -0.647688
H -4.581156 1.666303 0.245198
H -3.317361 2.671282 0.903126


