%chk=000268901.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268901

0 1
S -1.299443 2.193991 0.284067
S 2.968099 2.289691 -0.944436
O 0.124500 -1.170291 -2.161752
O 0.170206 -3.391878 1.894379
N 0.198706 -1.091239 1.406778
N 0.153202 -2.587328 -0.321904
C 0.065929 -0.244945 0.176107
C 1.226378 0.706385 0.029375
C -1.244797 0.460541 0.162891
C 0.117756 -1.327478 -0.972110
C 0.162629 -2.472968 1.114635
C 2.031904 1.162639 1.143290
C -2.509493 -0.051441 0.084090
C 1.619907 1.232891 -1.171018
C -3.531984 0.965101 0.125339
C 3.015038 2.027502 0.771738
C -3.034276 2.229099 0.235328
H -0.097937 -0.726168 2.305530
H 0.234261 -3.480675 -0.801457
H 1.855107 0.827509 2.156892
H -2.753725 -1.102486 -0.004356
H 1.192803 1.043174 -2.148283
H -4.583647 0.714236 0.069984
H 3.748276 2.511014 1.394332
H -3.576899 3.158526 0.284862


%chk=000268901-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268901

0 1
S -1.896456 1.811346 1.260547
S 2.686633 2.639110 -0.940699
O 0.083630 -1.506132 -1.789770
O 0.307032 -2.971707 2.683761
N 0.082448 -0.803511 1.722925
N 0.265773 -2.546413 0.329389
C -0.018525 -0.186726 0.375557
C 1.163104 0.750273 0.099813
C -1.370869 0.472020 0.150593
C 0.111024 -1.471281 -0.541132
C 0.223256 -2.182314 1.715912
C 2.476813 0.570643 0.684303
C -2.348635 0.205916 -0.794092
C 1.109589 1.808574 -0.793644
C -3.526968 1.031042 -0.662649
C 3.404426 1.495664 0.243117
C -3.457801 1.931738 0.385183
H -0.047161 -0.283174 2.589339
H 0.383948 -3.515259 0.031537
H 2.709136 -0.209609 1.412866
H -2.221236 -0.546835 -1.575018
H 0.262563 2.157668 -1.380543
H -4.391381 0.955046 -1.326270
H 4.451978 1.602870 0.517452
H -4.189819 2.666454 0.715823


