%chk=000190716.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190716

0 1
S 1.670252 2.382892 -0.000509
O -2.655158 1.073910 -0.000065
N -0.939266 -0.511541 -0.000318
N -3.195283 -1.186294 -0.000019
N 0.079769 1.685624 -0.000553
C 1.541566 -0.198299 -0.000098
C 0.164551 0.366929 -0.000316
C 2.497600 0.842516 -0.000180
C 1.970719 -1.531107 0.000166
C 3.867398 0.584504 -0.000008
C -4.685373 -1.081015 -0.000007
C 3.338980 -1.796231 0.000347
C -2.322776 -0.087041 -0.000194
C 4.279288 -0.747502 0.000259
C -5.227194 0.338449 0.000423
H 1.252795 -2.347865 0.000248
H -0.707586 -1.503709 -0.000255
H 4.592140 1.396569 -0.000071
H -5.056118 -1.625761 -0.901312
H -5.056060 -1.626274 0.901017
H 3.691644 -2.826658 0.000560
H -2.844373 -2.137229 -0.000337
H 5.343286 -0.985621 0.000405
H -4.883164 0.913195 0.874580
H -4.883237 0.913706 -0.873432
H -6.321801 0.343953 0.000466


%chk=000190716-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190716

0 1
S 1.818991 2.502612 -0.001743
O -2.667381 1.232985 -0.002522
N -0.922444 -0.361089 -0.002299
N -3.136543 -1.085587 -0.001848
N 0.112528 1.818636 -0.002612
C 1.545071 -0.135995 -0.000575
C 0.204517 0.476275 -0.001855
C 2.567126 0.858204 -0.000372
C 1.912305 -1.506796 0.000368
C 3.935468 0.512254 0.000751
C -4.620436 -1.117270 -0.000289
C 3.274257 -1.860545 0.001478
C -2.298963 0.033499 -0.003335
C 4.280264 -0.855032 0.001669
C -5.342139 0.242566 0.002708
H 1.154318 -2.300763 0.000254
H -0.708919 -1.359551 -0.001511
H 4.712851 1.282400 0.000902
H -4.948757 -1.690387 -0.892454
H -4.946628 -1.693088 0.890906
H 3.563368 -2.916506 0.002204
H -2.702076 -2.010559 -0.002057
H 5.336314 -1.145545 0.002538
H -5.088798 0.841683 0.890160
H -5.091275 0.844310 -0.883638
H -6.430423 0.043389 0.003971


