%chk=000179110.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179110

0 1
S -0.115668 -2.032730 0.006655
O -1.690212 2.631055 -0.001109
O 5.424815 1.135149 -0.031697
O 5.065099 -1.084145 -0.016303
N -1.086464 0.383126 0.001902
N 2.302151 -0.721507 0.014347
N 0.280619 0.588583 0.008059
N -2.774241 -1.365950 -0.004204
C -1.521683 -0.958479 0.000678
C 0.944480 -0.564703 0.010654
C -2.075453 1.492760 -0.002798
C -3.757864 -0.358454 -0.008418
C -3.427852 0.973299 -0.007627
C 3.169233 0.475604 0.017726
C -5.158283 -0.859335 -0.013597
C 4.612342 0.035683 -0.011423
H 2.742749 -1.640532 0.021994
H -4.198586 1.747071 -0.010859
H 2.967815 1.115086 0.919884
H 2.938303 1.140524 -0.859058
H -5.348758 -1.496540 -0.894721
H -5.901706 -0.051195 -0.016846
H -5.355564 -1.495730 0.866610
H 6.395828 0.897559 -0.050450


%chk=000179110-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179110

0 1
S -0.095923 -2.138328 -0.002296
O -1.607810 2.634808 -0.003002
O 5.426297 1.193150 -0.004687
O 4.994316 -1.094775 0.002071
N -1.079920 0.317516 -0.002070
N 2.311154 -0.703598 -0.000839
N 0.307228 0.549337 -0.000947
N -2.794078 -1.386484 -0.003254
C -1.537188 -1.001284 -0.002535
C 0.950536 -0.615656 -0.001000
C -2.020267 1.447735 -0.002017
C -3.757537 -0.366624 -0.003868
C -3.399646 0.979298 -0.003565
C 3.130264 0.507863 -0.001330
C -5.188848 -0.839921 -0.005147
C 4.589227 0.089693 -0.001520
H 2.806293 -1.599325 0.002676
H -4.162405 1.761217 -0.004430
H 2.919636 1.141609 0.882386
H 2.918692 1.141205 -0.884974
H -5.380084 -1.470254 -0.892453
H -5.896620 0.004154 -0.005551
H -5.381552 -1.470651 0.881557
H 6.379335 0.905514 -0.003805


