%chk=000287369.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287369

0 1
S -3.443891 0.000207 -0.805029
O 3.557984 1.081225 -0.415700
O 3.558033 -1.081136 -0.415811
N 3.001164 0.000026 -0.306359
C -1.180650 -0.000112 0.533212
C -2.641690 -0.000157 0.832952
C -0.489624 1.217287 0.390697
C -0.489539 -1.217467 0.390713
C 1.553512 -0.000021 -0.018954
C 0.875342 1.222613 0.114137
C 0.875427 -1.222701 0.114155
C -5.194783 -0.000118 -0.371274
H -2.954019 -0.886910 1.417939
H -2.953984 0.886366 1.418308
H -1.024982 2.163016 0.485817
H -1.024831 -2.163230 0.485848
H 1.424406 2.163865 -0.001112
H 1.424558 -2.163916 -0.001081
H -5.481101 -0.891738 0.196247
H -5.767739 0.000118 -1.310516
H -5.481294 0.891081 0.196812


%chk=000287369-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287369

0 1
S -3.576522 0.000026 -0.954562
O 3.663318 1.141818 -0.335832
O 3.663461 -1.141583 -0.335813
N 3.066068 0.000081 -0.236297
C -1.170063 -0.000182 0.481387
C -2.660248 -0.000269 0.723082
C -0.460064 1.223917 0.356586
C -0.459911 -1.224190 0.356596
C 1.600217 -0.000009 0.008011
C 0.928058 1.235828 0.120781
C 0.928214 -1.235929 0.120790
C -5.339452 -0.000019 -0.292798
H -2.981451 -0.901482 1.272358
H -2.981502 0.900733 1.272674
H -1.003076 2.171450 0.441881
H -1.002799 -2.171792 0.441908
H 1.492199 2.166773 0.023478
H 1.492472 -2.166804 0.023497
H -5.527517 -0.904608 0.307922
H -6.001648 0.000141 -1.172851
H -5.527454 0.904399 0.308202


