%chk=000262392.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262392

0 1
S 0.184365 2.751624 -0.000965
O 2.269973 -1.746003 0.000930
N -1.171887 0.443737 0.000242
N 1.221944 0.296647 0.000246
N -2.516042 -1.568280 -0.000953
C -1.263872 -0.973397 -0.000312
C 0.092118 1.084502 -0.000061
C 1.201491 -1.175854 0.000426
C -0.115963 -1.734786 -0.000160
C -2.415877 1.254995 0.000868
C 2.548045 0.972605 0.000192
H -0.151434 -2.823677 -0.000518
H -2.199061 2.348910 0.004912
H -3.010257 1.058817 0.908582
H -3.007273 1.064737 -0.910071
H 2.667875 1.608218 0.896059
H 2.668378 1.607048 -0.896433
H 3.351020 0.208755 0.000927
H -3.373754 -1.048565 -0.001907
H -2.586989 -2.574133 -0.001501


%chk=000262392-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000262392

0 1
S 0.182839 2.839091 -0.000131
O 2.308702 -1.784378 0.000473
N -1.170298 0.437334 0.000128
N 1.214557 0.314716 0.000235
N -2.511602 -1.527376 -0.000869
C -1.248478 -0.962687 -0.000426
C 0.081903 1.116530 0.000007
C 1.209769 -1.152888 0.000214
C -0.097469 -1.741867 -0.000335
C -2.423825 1.221559 0.000692
C 2.543713 0.965893 0.000427
H -0.158527 -2.830936 -0.000761
H -2.145965 2.287421 0.002581
H -3.017316 1.008168 0.908965
H -3.016334 1.011416 -0.908997
H 2.649963 1.605225 0.892515
H 2.650450 1.604779 -0.891928
H 3.293045 0.160908 0.000818
H -3.363562 -0.976521 -0.001971
H -2.588764 -2.540486 -0.001134


