%chk=000281309.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281309

0 1
S -0.560310 0.539788 0.029891
O 5.749078 0.363783 0.285522
O -2.809717 2.485665 -0.007789
O -6.186207 -0.647804 -0.075614
N -4.525546 0.976343 -0.041420
N -2.657944 -1.116972 -0.013937
N -3.990260 -1.363506 -0.039039
C 1.736854 -0.690699 0.053588
C 0.297200 -1.072195 0.028729
C 2.407693 -0.541172 1.285756
C 2.433297 -0.472317 -1.143439
C 4.429258 0.022986 0.102589
C 3.749140 -0.188334 1.322265
C 3.784737 -0.115576 -1.132646
C -2.251734 0.124689 -0.003145
C -3.133424 1.326901 -0.015791
C -5.011287 -0.358018 -0.053755
C 6.551350 0.628378 -0.891075
H 0.020133 -1.663311 -0.866121
H -0.006556 -1.679009 0.904290
H 1.867297 -0.701803 2.219968
H 1.919677 -0.578363 -2.100218
H 4.285378 -0.067668 2.261265
H 4.307402 0.049883 -2.068527
H -5.225844 1.732412 -0.051237
H -4.260671 -2.357043 -0.045703
H 6.145839 1.480294 -1.444345
H 6.621933 -0.268628 -1.512558
H 7.524334 0.876295 -0.446108


%chk=000281309-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281309

0 1
S -0.677403 0.905398 0.034769
O 5.919690 0.205489 0.317615
O -3.222879 2.570511 0.095376
O -6.268459 -1.006350 -0.051775
N -4.739217 0.789416 0.022662
N -2.622601 -1.023717 -0.051569
N -3.957581 -1.411224 -0.068491
C 1.748799 -0.516426 0.028111
C 0.268177 -0.777526 -0.030098
C 2.423172 -0.427678 1.277513
C 2.507375 -0.350823 -1.156043
C 4.549475 -0.027269 0.143443
C 3.805783 -0.188324 1.341078
C 3.898210 -0.108886 -1.113163
C -2.372331 0.280009 0.003696
C -3.433246 1.331168 0.045436
C -5.086712 -0.579682 -0.034024
C 6.736732 0.393549 -0.884651
H -0.051560 -1.267242 -0.962944
H -0.103622 -1.363644 0.824617
H 1.855033 -0.546093 2.207666
H 2.005956 -0.410038 -2.129577
H 4.332333 -0.121457 2.297698
H 4.453142 0.011205 -2.048100
H -5.520752 1.453366 0.049847
H -4.113137 -2.418551 -0.110295
H 6.398981 1.272805 -1.466730
H 6.720410 -0.507841 -1.527770
H 7.757331 0.564855 -0.512901


