%chk=000249751.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249751

0 1
S -0.008428 -1.015550 -0.171552
O -1.660940 1.506342 -0.837703
O 1.663702 1.218514 1.150313
C -1.074304 -0.015354 0.883361
C 1.066726 0.224089 -0.917659
C -3.499909 0.404630 0.176024
C 3.494849 0.417342 -0.125711
C -2.046872 0.702931 -0.014903
C 2.044054 0.664612 0.140395
C -3.959310 -0.909296 0.337485
C 3.943777 -0.807436 -0.637457
C -4.410662 1.471445 0.163425
C 4.414209 1.433439 0.174388
C -5.325912 -1.152106 0.500732
C 5.308561 -1.008058 -0.861797
C -5.775012 1.224818 0.337416
C 5.776712 1.232074 -0.061329
C -6.232325 -0.086185 0.506693
C 6.223583 0.012237 -0.579816
H -1.545566 -0.671081 1.638520
H -0.462328 0.722834 1.465701
H 1.533516 -0.206655 -1.822586
H 0.461416 1.097247 -1.277864
H -3.258256 -1.744154 0.321776
H 3.235969 -1.609635 -0.847689
H -4.048025 2.490028 0.010575
H 4.059652 2.375465 0.597774
H -5.685146 -2.172927 0.621710
H 5.659644 -1.960856 -1.255082
H -6.481588 2.053524 0.334440
H 6.489987 2.023224 0.165231
H -7.296676 -0.278282 0.639214
H 7.286500 -0.145420 -0.760525


%chk=000249751-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249751

0 1
S -0.002052 -0.483550 -0.104275
O -1.980997 2.360975 -0.153903
O 1.998562 2.222777 0.752687
C -0.952026 0.609216 1.143071
C 0.951614 0.918990 -0.984172
C -3.450429 0.513581 0.353709
C 3.447933 0.578381 -0.260511
C -2.136112 1.236556 0.417296
C 2.141868 1.304042 -0.113256
C -3.640271 -0.796678 0.870935
C 3.617719 -0.543599 -1.116333
C -4.549127 1.183598 -0.252949
C 4.558690 1.046500 0.495170
C -4.902920 -1.421023 0.783751
C 4.872657 -1.181730 -1.214225
C -5.809773 0.561991 -0.334767
C 5.811978 0.413016 0.392097
C -5.990295 -0.743429 0.184490
C 5.972545 -0.703761 -0.464264
H -1.218056 -0.051662 1.980620
H -0.250927 1.390689 1.477724
H 1.211942 0.527838 -1.978383
H 0.254752 1.767766 -1.076062
H -2.807629 -1.342507 1.326585
H 2.774863 -0.936696 -1.694083
H -4.381971 2.190677 -0.649277
H 4.406663 1.909055 1.152492
H -5.040055 -2.433246 1.179255
H 4.994023 -2.050145 -1.870654
H -6.650888 1.087768 -0.799492
H 6.662807 0.783887 0.973862
H -6.970536 -1.229179 0.121569
H 6.947045 -1.198299 -0.545209


