%chk=000236639.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236639

0 1
S 1.886082 1.041836 -0.001485
O 4.468535 0.965587 -0.002946
N -0.812383 1.519643 -0.001051
N -0.239826 -0.714697 -0.000093
N -2.586235 -1.601181 0.000821
N -4.300925 0.145412 0.000391
C -2.017651 0.798837 -0.000439
C 0.212871 0.559121 -0.000829
C -1.642163 -0.612920 0.000149
C 2.701204 -0.579444 -0.000167
C -3.385573 1.131339 -0.000281
C 4.160896 -0.206438 -0.002738
C 5.140861 -1.332991 -0.005138
C -3.867633 -1.170191 0.000778
H -0.723801 2.519975 -0.001543
H 2.403263 -1.190794 0.878018
H 2.400659 -1.193751 -0.875415
H -3.743111 2.166098 -0.000680
H 6.178409 -0.959943 -0.003332
H 5.029173 -1.981040 0.876127
H 5.030519 -1.975493 -0.890682
H -4.660671 -1.937267 0.001638


%chk=000236639-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236639

0 1
S 1.896573 1.313081 -0.001761
O 4.775180 0.920628 -0.002926
N -0.879385 1.592045 -0.000971
N -0.167303 -0.592291 -0.000333
N -2.424263 -1.618406 0.000634
N -4.287186 -0.008120 0.000634
C -2.040957 0.810015 -0.000314
C 0.205994 0.701020 -0.000983
C -1.573459 -0.555570 0.000021
C 2.721572 -0.389020 -0.000703
C -3.424666 1.054397 0.000041
C 4.236358 -0.215980 -0.002703
C 5.040690 -1.508769 -0.004758
C -3.745632 -1.272254 0.000813
H -0.821725 2.609762 -0.001310
H 2.373500 -0.944285 0.887060
H 2.371172 -0.946694 -0.886020
H -3.868141 2.055988 -0.000159
H 6.116321 -1.276776 -0.001816
H 4.793848 -2.123070 0.881403
H 4.797843 -2.117029 -0.896230
H -4.463833 -2.096975 0.001482


