%chk=000218893.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218893

0 1
S -5.069110 -0.615634 -1.345414
O 1.381811 -0.477204 0.321051
N -3.378361 -0.084057 0.670130
N 4.432710 1.280458 -0.821560
C -4.538867 0.846811 0.832235
C -2.180057 0.590740 0.072054
C -3.835343 -1.244642 -0.111173
C -5.354658 0.953355 -0.461620
C -0.929742 -0.216620 0.452312
C 0.336041 0.485678 -0.029922
C 2.679213 -0.141319 0.033549
C 3.618756 -1.124276 0.414158
C 3.116342 1.049152 -0.581785
C 4.961440 -0.875140 0.162818
C 5.331587 0.338736 -0.456792
H -4.191629 1.841470 1.178775
H -5.167827 0.432872 1.655353
H -2.252836 0.703653 -1.032126
H -2.102930 1.617469 0.492822
H -3.021384 -1.773268 -0.640227
H -4.343861 -1.964456 0.564007
H -6.433356 1.078231 -0.267263
H -5.032046 1.794374 -1.098294
H -0.889250 -0.367896 1.552537
H -0.971689 -1.241802 0.029868
H 0.533349 1.430953 0.502735
H 0.354621 0.639431 -1.122205
H 3.276716 -2.042015 0.889220
H 2.428862 1.837531 -0.894425
H 5.722280 -1.603279 0.438257
H 6.381517 0.565694 -0.668575


%chk=000218893-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218893

0 1
S -5.009050 -0.508203 -1.556387
O 1.424015 -0.583882 0.393599
N -3.460738 -0.095931 0.711364
N 4.365213 1.328291 -0.925892
C -4.599278 0.846166 0.834893
C -2.208578 0.517318 0.184958
C -3.940402 -1.233698 -0.035676
C -5.214760 1.108890 -0.583219
C -0.967821 -0.326755 0.543050
C 0.318776 0.327964 0.034627
C 2.725305 -0.199913 0.053093
C 3.758360 -1.097464 0.422840
C 3.074330 1.001034 -0.621032
C 5.088331 -0.760862 0.108263
C 5.350681 0.458774 -0.564416
H -4.268772 1.782418 1.316043
H -5.366868 0.378162 1.478062
H -2.266765 0.660643 -0.920170
H -2.113428 1.518596 0.646097
H -3.133999 -1.849905 -0.454560
H -4.645049 -1.838709 0.552552
H -6.286261 1.354572 -0.517370
H -4.681834 1.910405 -1.120352
H -0.915599 -0.452764 1.638925
H -1.043027 -1.337829 0.101404
H 0.484830 1.316010 0.512611
H 0.294328 0.464976 -1.066708
H 3.499983 -2.025512 0.941484
H 2.315993 1.727386 -0.931372
H 5.911776 -1.429769 0.378306
H 6.372603 0.754592 -0.824516


