%chk=000196043.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196043

0 1
S -1.975540 2.016884 -1.592153
O 1.061943 -0.919216 1.895333
O 1.202187 -1.752554 -0.186738
O -1.315126 -1.428254 -0.860531
O -1.528326 -0.915337 1.311670
N 0.553366 1.039135 -1.159557
N 0.202704 3.110918 -0.289355
N 4.093633 -1.331468 0.671647
N -4.316696 -0.601444 0.510650
C 2.979374 0.612662 -0.553004
C 3.012933 -0.326332 0.681370
C 1.758820 1.452156 -0.574325
C -0.367419 2.081603 -0.958211
C -2.954282 1.426979 -0.183477
C -3.196023 -0.081290 -0.307187
C 1.517293 2.734176 -0.046126
C 1.691487 -1.101273 0.725546
C -1.953841 -0.836168 0.174203
H 3.058727 0.014885 -1.488707
H 3.880916 1.263608 -0.541889
H 3.098842 0.288098 1.623705
H 0.375034 0.146080 -1.607004
H -3.912507 1.986260 -0.209142
H -2.479368 1.701079 0.782054
H -3.396779 -0.364881 -1.383452
H 2.200155 3.379527 0.478755
H 5.003050 -0.901615 0.806808
H 4.113137 -1.864017 -0.194742
H -5.207031 -0.228334 0.196720
H -4.202768 -0.376524 1.497166
H 0.108243 -1.311918 1.929512
H -0.492835 -1.983825 -0.576842


%chk=000196043-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196043

0 1
S -1.944934 1.943154 -1.847808
O 0.988491 -0.621358 1.849415
O 1.197247 -1.717014 -0.181535
O -1.243047 -1.463988 -0.809585
O -1.489584 -0.663400 1.348604
N 0.678839 1.138583 -1.254439
N 0.056451 2.995427 -0.130622
N 4.051337 -1.517287 0.425205
N -4.245296 -0.543261 0.753447
C 3.054530 0.686099 -0.454545
C 3.096632 -0.445763 0.676553
C 1.798335 1.512957 -0.493291
C -0.347158 2.050166 -1.004788
C -3.073895 1.352647 -0.416662
C -3.248488 -0.195949 -0.267373
C 1.379758 2.663967 0.193066
C 1.685741 -1.010768 0.774517
C -1.920370 -0.813302 0.152739
H 3.197080 0.163136 -1.419320
H 3.932898 1.336125 -0.296030
H 3.325645 0.030440 1.643593
H 0.604629 0.319972 -1.859966
H -4.057021 1.796879 -0.649939
H -2.680857 1.801000 0.511509
H -3.536529 -0.627698 -1.239969
H 1.948577 3.267856 0.896941
H 5.033765 -1.303557 0.592279
H 3.861725 -2.099816 -0.392253
H -5.210678 -0.296116 0.527208
H -3.961665 -0.323986 1.712711
H -0.063374 -0.752038 1.751432
H -0.255483 -1.733506 -0.518396


