%chk=000281092.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281092

0 1
S 1.656964 -1.708102 0.559493
O 2.631580 -2.550847 -0.104406
O 1.462971 -1.880857 1.986621
N -1.594822 0.086503 -0.438821
C -0.288069 -0.493621 -0.862468
C 0.086407 -1.866856 -0.260064
C 0.831137 0.492637 -0.537737
C -2.746449 -0.716781 -0.969843
C -1.700660 0.284587 1.044460
C -4.066705 0.010300 -0.664551
C -3.008858 1.020801 1.375743
C 1.915639 -0.040941 0.176021
C -4.225956 0.257164 0.840400
C 0.834769 1.830047 -0.928102
C 3.013761 0.741785 0.498809
C 1.943486 2.624657 -0.600460
C 3.026005 2.088692 0.103162
H -0.332983 -0.597922 -1.984035
H -0.692284 -2.227514 0.439217
H 0.116013 -2.644204 -1.044579
H -2.777380 -1.746599 -0.552916
H -2.622242 -0.813328 -2.070138
H -0.834331 0.899963 1.374356
H -1.649304 -0.671292 1.610687
H -4.914642 -0.582675 -1.052825
H -4.087245 0.978548 -1.204299
H -2.982165 2.037100 0.934028
H -3.087178 1.157634 2.470092
H -5.151722 0.829055 1.037173
H -4.339783 -0.704108 1.376387
H -0.017676 2.248713 -1.463573
H 3.858396 0.324908 1.051280
H 1.958225 3.673763 -0.899691
H 3.881603 2.716091 0.347579


%chk=000281092-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281092

0 1
S 1.595159 -1.729985 0.758025
O 2.839394 -2.697424 0.322575
O 1.078952 -1.744809 2.312945
N -1.613839 0.029222 -0.412365
C -0.327332 -0.483367 -0.931431
C 0.082915 -1.918096 -0.467311
C 0.819830 0.489675 -0.613352
C -2.800428 -0.662271 -0.978652
C -1.686505 0.168796 1.068125
C -4.093060 0.102627 -0.627300
C -2.954532 0.946351 1.473768
C 1.880132 0.042669 0.185542
C -4.224434 0.275102 0.903352
C 0.866388 1.821780 -1.083850
C 2.989967 0.821367 0.543681
C 1.968191 2.641189 -0.750328
C 3.027777 2.147312 0.053904
H -0.436928 -0.520220 -2.034104
H -0.687730 -2.444142 0.114394
H 0.494046 -2.546155 -1.271956
H -2.893219 -1.711458 -0.594307
H -2.678572 -0.723000 -2.077440
H -0.786695 0.703490 1.418509
H -1.687886 -0.827268 1.576067
H -4.963765 -0.444682 -1.036610
H -4.061952 1.097478 -1.112140
H -2.878000 1.981529 1.088096
H -3.004410 1.002303 2.577550
H -5.122702 0.871879 1.149071
H -4.359008 -0.720443 1.375259
H 0.038423 2.205381 -1.689559
H 3.792353 0.417534 1.168465
H 2.006397 3.671611 -1.119563
H 3.877578 2.793327 0.297938


