%chk=000267095.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267095

0 1
S -0.000774 0.957422 0.624297
O -0.001007 -0.369020 -0.006684
O -0.001298 1.054314 2.054180
N -2.658174 -0.345841 -0.352657
N 2.656394 -0.347733 -0.350592
N -3.862016 1.550332 0.148526
N 3.861237 1.547643 0.151192
C -1.382132 1.840519 -0.037967
C 1.381706 1.839556 -0.036889
C -2.628852 1.043317 -0.057011
C 2.627848 1.041457 -0.055106
C -4.010821 -0.726990 -0.308079
C 4.008745 -0.729815 -0.305137
C -4.752591 0.469006 -0.000508
C 4.751145 0.465692 0.002814
C -4.653136 -1.963289 -0.505323
C 4.650319 -1.966587 -0.501851
C -6.157128 0.418426 0.106236
C 6.155582 0.414129 0.110471
C -6.032390 -1.977753 -0.393249
C 6.029485 -1.982011 -0.388871
C -6.774581 -0.803188 -0.092082
C 6.772305 -0.807932 -0.087329
H -1.592423 2.775440 0.551399
H -1.206258 2.230687 -1.067786
H 1.206880 2.229963 -1.066795
H 1.592269 2.774274 0.552701
H -1.854959 -0.959286 -0.496128
H 1.852843 -0.960617 -0.494613
H -4.083853 -2.859194 -0.732367
H 4.080547 -2.862109 -0.729180
H -6.714922 1.323621 0.339601
H 6.713854 1.318958 0.344122
H -6.576765 -2.911235 -0.536522
H 6.573304 -2.915886 -0.531691
H -7.858573 -0.881731 -0.016595
H 7.856192 -0.887238 -0.011123


%chk=000267095-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267095

0 1
S -0.000284 1.094376 0.205581
O 0.000401 -0.216621 -0.846110
O -0.001052 0.812515 1.802740
N -2.848249 -0.093881 -0.799730
N 2.847103 -0.094982 -0.798097
N -3.948875 1.536079 0.389616
N 3.948132 1.533624 0.392788
C -1.661182 2.092906 -0.448599
C 1.661475 2.092454 -0.446957
C -2.816176 1.204766 -0.271201
C 2.815690 1.203469 -0.269032
C -4.082888 -0.645173 -0.452527
C 4.080880 -0.647544 -0.449845
C -4.769716 0.397879 0.272923
C 4.768022 0.394693 0.276489
C -4.665949 -1.910245 -0.679574
C 4.662990 -1.913080 -0.676741
C -6.078928 0.178551 0.765455
C 6.076593 0.174024 0.770122
C -5.967408 -2.106622 -0.175514
C 5.963817 -2.110789 -0.171572
C -6.664493 -1.079639 0.533682
C 6.661207 -1.084642 0.538532
H -1.738830 3.014127 0.143652
H -1.342016 2.255868 -1.489644
H 1.343181 2.255875 -1.488195
H 1.739120 3.013436 0.145673
H -1.995316 -0.556213 -1.151250
H 1.994165 -0.556397 -1.150776
H -4.141584 -2.703701 -1.220954
H 4.138400 -2.705893 -1.218846
H -6.601809 0.967769 1.313373
H 6.599713 0.962613 1.318716
H -6.460174 -3.072700 -0.330905
H 6.455845 -3.077267 -0.326814
H -7.674226 -1.283155 0.905630
H 7.670425 -1.289183 0.911313


