%chk=000239839.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239839

0 1
S -1.945066 2.143376 -0.795548
O -1.061005 1.734976 -2.179564
O -2.999104 2.971319 -1.353244
O -1.039754 2.735976 0.143111
N -0.385895 -0.139219 0.118051
N 0.447675 -1.076395 -0.027964
N 5.976045 -0.053060 0.155215
N 2.302801 -3.149773 -0.291520
C -2.604846 0.623192 -0.331305
C -1.787909 -0.450899 0.055549
C -4.578657 -0.751457 0.024183
C 3.682297 0.805005 0.359322
C -3.995719 0.463934 -0.353341
C 1.816965 -0.762260 0.059052
C 4.601158 -0.284555 0.166137
C 2.741598 -1.842245 -0.122221
C 2.329725 0.544133 0.299274
C -2.367010 -1.678106 0.437284
C -3.750187 -1.820023 0.421868
C 4.128894 -1.584615 -0.068408
C -6.061595 -0.923874 0.011246
C 4.177236 2.193114 0.608124
H -4.631562 1.300118 -0.673113
H 1.602824 1.360076 0.435317
H -1.724857 -2.504396 0.742589
H -4.200482 -2.768481 0.718646
H 4.829630 -2.399969 -0.210136
H -6.589850 -0.034234 -0.359061
H -6.363790 -1.763358 -0.631481
H -6.448980 -1.127383 1.020419
H 4.752647 2.261893 1.540064
H 4.801132 2.554961 -0.220795
H 3.345672 2.909510 0.703131
H 6.338426 0.813471 0.515255
H 6.607334 -0.834025 0.208867
H 1.325489 -3.323239 -0.477968
H 2.940755 -3.848477 -0.629681
H -1.151831 2.358087 -2.916054


%chk=000239839-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239839

0 1
S -2.166914 2.504873 0.054537
O -0.613336 2.401896 -0.826905
O -3.211078 3.435434 -0.756044
O -1.895916 2.812477 1.621887
N -0.412242 -0.031649 -0.114373
N 0.453207 -1.003821 0.101589
N 5.993250 -0.116141 0.059162
N 2.143722 -3.062078 0.534347
C -2.738275 0.686427 -0.128639
C -1.792239 -0.372849 -0.108107
C -4.624563 -0.851992 -0.266346
C 3.746740 0.825980 -0.150852
C -4.119846 0.472336 -0.211390
C 1.802732 -0.693802 0.074607
C 4.623313 -0.314019 0.067762
C 2.692569 -1.820645 0.307246
C 2.373769 0.605058 -0.141087
C -2.305563 -1.699216 -0.155124
C -3.690190 -1.924631 -0.224783
C 4.090511 -1.606277 0.292922
C -6.113512 -1.117382 -0.373730
C 4.328681 2.208550 -0.372570
H -4.795963 1.333817 -0.247853
H 1.705675 1.459196 -0.290705
H -1.593901 -2.529573 -0.153751
H -4.063851 -2.955101 -0.265057
H 4.769278 -2.450587 0.463477
H -6.696220 -0.183101 -0.320296
H -6.362129 -1.614959 -1.330337
H -6.461301 -1.782517 0.438466
H 4.932192 2.549204 0.493099
H 4.975628 2.248909 -1.272322
H 3.525387 2.948120 -0.517930
H 6.385570 0.808719 -0.093703
H 6.634727 -0.889721 0.214520
H 1.125895 -3.128478 0.546274
H 2.719315 -3.879183 0.713525
H -0.304918 1.379822 -0.560218


