%chk=000211753.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211753

0 1
S -5.134345 0.395896 -0.221686
N -1.205788 -0.429204 0.250787
N 2.470172 0.351294 0.031211
C 0.016700 0.420121 0.115659
C 1.252460 -0.501857 0.178021
C -2.458010 0.363494 0.034682
C 3.703117 -0.472005 -0.179131
C -3.634802 -0.611453 0.029732
C 4.946855 0.401144 -0.022694
H 0.083560 1.221192 0.881623
H -0.003429 0.931175 -0.874655
H 1.207936 -1.224362 -0.668907
H 1.246821 -1.107124 1.108815
H -1.226902 -0.857227 1.183173
H -2.380322 0.875469 -0.953742
H -2.603944 1.161082 0.797270
H 2.582342 0.939475 0.863662
H 3.765506 -1.346551 0.505003
H 3.652896 -0.877809 -1.215703
H -3.709540 -1.172788 0.978329
H -3.516205 -1.357415 -0.780228
H 4.884938 1.294248 -0.660481
H 5.085940 0.744606 1.007828
H 5.849723 -0.146880 -0.314263
H -6.023480 -0.592920 -0.450607


%chk=000211753-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000211753

0 1
S -5.266291 0.422467 -0.040652
N -1.212401 -0.385702 0.196386
N 2.501476 0.291952 0.041423
C 0.025765 0.411009 0.063581
C 1.261617 -0.507125 0.086892
C -2.471100 0.381804 0.096367
C 3.749995 -0.497169 -0.040576
C -3.654096 -0.592208 -0.023103
C 4.980983 0.424988 -0.060082
H 0.131377 1.189827 0.864254
H -0.000011 0.949572 -0.901232
H 1.231924 -1.167033 -0.799941
H 1.205437 -1.178946 0.985905
H -1.192368 -0.971854 1.043355
H -2.421698 1.007717 -0.814177
H -2.639997 1.075170 0.957857
H 2.540307 0.973654 0.813374
H 3.849208 -1.233659 0.798063
H 3.715481 -1.090123 -0.975870
H -3.686985 -1.282052 0.838190
H -3.573628 -1.170201 -0.956478
H 4.919066 1.128254 -0.908817
H 5.050319 1.017878 0.872534
H 5.911657 -0.163025 -0.153736
H -6.103839 -0.633594 -0.359818


