%chk=000231438.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231438

0 1
S -1.640912 -1.035079 0.184256
N 3.306060 -0.473840 0.378642
N -0.337368 1.218343 -0.473613
N 2.081599 1.570408 -0.396881
N 2.953281 -1.742108 0.771495
C -3.078725 0.019429 -0.317284
C 1.043524 -0.608826 0.243455
C -0.220421 -0.052594 -0.041511
C -3.185373 0.012955 -1.827087
C -4.260794 -0.623996 0.382616
C 2.177091 0.268793 0.042559
C 1.609287 -1.850324 0.700434
C 0.815649 1.975509 -0.632028
H -2.904288 1.057848 0.059236
H -4.070244 0.570797 -2.163204
H -2.312462 0.493618 -2.295100
H -3.265204 -0.998304 -2.245882
H -5.186368 -0.072736 0.160518
H -4.150143 -0.627916 1.476063
H -4.433250 -1.661613 0.065251
H 1.074866 -2.754181 0.957667
H 4.274268 -0.182943 0.360064
H 0.666027 3.009261 -0.986166


%chk=000231438-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231438

0 1
S -1.650803 -1.202542 0.209223
N 3.330012 -0.397387 0.364355
N -0.362442 1.150530 -0.433638
N 2.052000 1.585819 -0.361073
N 3.077693 -1.718215 0.753418
C -3.086469 -0.035271 -0.331474
C 1.097468 -0.642999 0.250183
C -0.208207 -0.135947 -0.018495
C -3.197544 -0.013402 -1.863305
C -4.356288 -0.534806 0.376446
C 2.175049 0.289249 0.052274
C 1.725713 -1.859778 0.681793
C 0.757237 1.937046 -0.581392
H -2.773161 0.955161 0.039361
H -4.017199 0.668279 -2.162970
H -2.263846 0.353967 -2.319541
H -3.421685 -1.018240 -2.263367
H -5.202811 0.124248 0.107592
H -4.243409 -0.521638 1.474054
H -4.618734 -1.561953 0.063597
H 1.276482 -2.816371 0.940351
H 4.288783 -0.056520 0.340827
H 0.578260 2.963271 -0.914720


