%chk=000211736.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211736

0 1
S -2.951321 0.636084 0.930801
S -1.009649 2.781126 1.576074
O -0.735113 -0.897259 -1.825453
N -0.684473 0.876250 -0.318449
C 0.694378 1.372043 -0.700331
C -2.643095 -0.612140 -0.358218
C -1.276700 -0.285072 -0.938791
C -2.679878 -2.018586 0.234169
C 1.732227 0.437790 -0.105257
C -1.409947 1.485178 0.693649
C 0.811640 1.525827 -2.214242
C -4.089697 -2.438564 0.631734
C 2.399293 0.828698 1.065910
C 2.038237 -0.795242 -0.696995
C 3.370873 -0.002270 1.630112
C 3.010737 -1.623546 -0.130562
C 3.679835 -1.228156 1.031968
H 0.814553 2.399774 -0.243895
H -3.416542 -0.506147 -1.161972
H -2.000346 -2.092627 1.110204
H -2.273474 -2.734125 -0.517706
H 1.810093 1.895464 -2.482927
H 0.076582 2.237658 -2.608001
H 0.666500 0.575682 -2.751689
H -4.500704 -1.807663 1.430480
H -4.787468 -2.398848 -0.213131
H -4.096899 -3.470372 1.007565
H 2.159314 1.779481 1.543399
H 1.508019 -1.113059 -1.599096
H 3.886048 0.306082 2.538353
H 3.245882 -2.578980 -0.596487
H 4.437995 -1.873580 1.471583


%chk=000211736-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211736

0 1
S -3.108595 0.845729 0.744190
S -1.097905 3.123570 1.193713
O -0.635624 -1.079213 -1.700086
N -0.696829 0.888127 -0.394833
C 0.703256 1.329901 -0.771677
C -2.632410 -0.634786 -0.350548
C -1.236096 -0.320776 -0.898978
C -2.659986 -1.977755 0.415343
C 1.742452 0.366707 -0.183235
C -1.496662 1.652314 0.469764
C 0.794610 1.592009 -2.287003
C -4.077000 -2.378091 0.869730
C 2.071930 0.491789 1.192196
C 2.394287 -0.624669 -0.956161
C 3.028654 -0.360450 1.785126
C 3.358063 -1.472819 -0.366425
C 3.677502 -1.346039 1.004928
H 0.805688 2.298133 -0.246280
H -3.345463 -0.661833 -1.193499
H -1.979529 -1.914395 1.284982
H -2.245180 -2.744168 -0.267911
H 1.799391 1.981745 -2.526455
H 0.052270 2.354231 -2.581857
H 0.618121 0.682433 -2.881225
H -4.500099 -1.637019 1.572849
H -4.764432 -2.464649 0.007473
H -4.056406 -3.354732 1.384593
H 1.577928 1.263783 1.795515
H 2.140964 -0.746479 -2.013172
H 3.274189 -0.250286 2.847304
H 3.854744 -2.236067 -0.975891
H 4.425066 -2.005343 1.460328


