%chk=000280819.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280819

0 1
S -3.923718 0.865591 -0.969829
P 2.856153 0.276024 0.693484
O 1.624247 -0.704808 0.111640
O 3.554586 0.692280 -0.730618
O 3.841614 -0.888179 1.228396
O 2.501215 1.349724 1.625391
N -5.586475 -0.734438 0.706474
C -1.711730 -0.695485 -1.269091
C -1.588873 1.101531 0.406930
C 0.338844 -0.266029 -0.065450
C -2.304440 0.376572 -0.567229
C -0.373180 -1.010530 -1.022356
C -0.246409 0.782737 0.652355
C -2.487546 -1.493850 -2.258679
C -2.233926 2.194662 1.185849
C 3.360528 2.059712 -1.191669
C 4.198597 -1.942787 0.263509
C 1.969241 2.250281 -1.763360
C 5.243724 -2.743264 1.012297
C -4.883510 -0.102201 0.043835
H 0.127004 -1.825576 -1.539572
H 0.309449 1.335037 1.419761
H -3.322784 -2.028167 -1.775411
H -2.931740 -0.862430 -3.044650
H -1.878742 -2.254638 -2.766432
H -1.537586 2.695622 1.874955
H -2.657859 2.976182 0.536235
H -3.064589 1.812302 1.802466
H 3.590803 2.772208 -0.375423
H 4.145950 2.123163 -1.973675
H 3.286030 -2.532377 0.047709
H 4.599599 -1.478389 -0.658130
H 1.938286 3.108287 -2.447565
H 1.645489 1.369997 -2.338336
H 1.208269 2.436789 -0.991742
H 5.558365 -3.626548 0.445442
H 6.134587 -2.137075 1.228240
H 4.857523 -3.081326 1.985847


%chk=000280819-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000280819

0 1
S -4.146585 0.936642 -0.922349
P 2.883768 0.268416 0.626634
O 1.523486 -0.805397 0.365979
O 3.354555 0.641897 -0.994100
O 4.013918 -0.880976 1.163133
O 2.681076 1.509101 1.590830
N -5.790980 -1.233512 0.212025
C -1.848182 -0.729982 -1.179268
C -1.697444 1.129537 0.483895
C 0.213418 -0.343250 0.080575
C -2.412439 0.377247 -0.487551
C -0.510909 -1.078907 -0.877050
C -0.361045 0.750760 0.762598
C -2.626064 -1.536913 -2.199516
C -2.313973 2.296738 1.233220
C 3.483902 2.083700 -1.391893
C 4.326005 -2.098445 0.336290
C 2.145470 2.640496 -1.877279
C 5.413069 -2.843460 1.101462
C -5.093525 -0.364839 -0.232447
H -0.027404 -1.920123 -1.382041
H 0.219033 1.296008 1.514068
H -3.447459 -2.102141 -1.719972
H -3.090556 -0.885775 -2.961802
H -1.970425 -2.261173 -2.709702
H -1.612329 2.688241 1.987699
H -2.580054 3.125703 0.552082
H -3.244556 1.996188 1.747190
H 3.880424 2.663714 -0.538394
H 4.234872 2.048572 -2.198042
H 3.400116 -2.692041 0.235764
H 4.666411 -1.765875 -0.661524
H 2.290042 3.662495 -2.275525
H 1.728516 2.010146 -2.681286
H 1.413330 2.695781 -1.052518
H 5.690356 -3.761970 0.551437
H 6.312978 -2.216135 1.214245
H 5.056179 -3.129865 2.104733


