%chk=000248815.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248815

0 1
S 2.833728 -1.390677 -0.241476
N -0.879432 -0.023640 0.063781
N -2.124680 -0.611347 0.073699
N -4.452861 -0.362769 0.293674
N -3.206111 1.574105 -0.361778
C 1.474758 -0.309290 -0.010915
C 1.925877 0.969587 0.161857
C 3.364446 1.081387 0.108758
C 3.996684 -0.105384 -0.102956
C 0.129647 -0.854522 -0.027550
C -3.177623 0.206479 0.009265
H 1.283719 1.826017 0.324857
H 3.861264 2.034984 0.230100
H 5.052200 -0.297946 -0.183939
H 0.041441 -1.950967 -0.117092
H -5.200382 -0.094178 -0.337599
H -4.434747 -1.373309 0.432813
H -2.303617 2.045868 -0.338576
H -3.946212 2.145502 0.026177


%chk=000248815-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248815

0 1
S 2.864820 -1.444545 -0.036659
N -0.945529 -0.037857 0.008162
N -2.177326 -0.731750 -0.001265
N -4.483942 -0.394811 0.073557
N -3.058797 1.505304 -0.058322
C 1.456542 -0.293878 -0.007739
C 1.913755 1.027900 0.015847
C 3.344688 1.151295 0.011643
C 4.011284 -0.067629 -0.014800
C 0.111976 -0.832921 -0.011970
C -3.209217 0.137466 0.003825
H 1.223819 1.873929 0.035940
H 3.867792 2.110860 0.027945
H 5.080984 -0.267774 -0.023054
H -0.020131 -1.927912 -0.033080
H -5.307451 0.146212 -0.173472
H -4.545638 -1.409579 0.119755
H -2.080343 1.806665 -0.075980
H -3.809187 2.158926 0.142769


