%chk=000279495.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279495

0 1
S 1.005385 0.253730 0.606598
O 1.048694 1.704049 0.776416
O 1.462159 -0.605773 1.691525
N 1.962771 -0.182723 -0.768101
N -1.174262 -1.412431 0.248768
N -2.759921 0.012026 -0.541780
N -1.412343 2.062188 -0.675151
C -0.571677 -0.145437 0.165650
C -1.579109 0.725143 -0.333651
C -2.476645 -1.284882 -0.185109
C 1.752316 0.695337 -1.947384
C 3.399615 -0.392576 -0.455909
C -0.501778 -2.626691 0.712678
H -3.194814 -2.093125 -0.236063
H 2.324196 0.310709 -2.808755
H 2.048506 1.746026 -1.783210
H 0.685893 0.674883 -2.238650
H 3.494955 -1.036919 0.440182
H 3.963405 0.537419 -0.276317
H 3.881090 -0.927324 -1.292500
H 0.205302 -2.393892 1.548745
H -1.225711 -3.371176 1.081366
H 0.097845 -3.081608 -0.099566
H -0.669285 2.562724 -0.172210
H -2.260986 2.602024 -0.801671


%chk=000279495-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279495

0 1
S 1.016539 0.442338 0.622248
O 1.017861 2.091904 0.533232
O 1.550296 -0.311114 1.972043
N 2.042149 -0.384962 -0.806502
N -1.147507 -1.352726 0.170592
N -2.875550 0.030444 -0.380931
N -1.753546 2.184660 -0.278421
C -0.653598 -0.026049 0.172077
C -1.740009 0.821027 -0.161700
C -2.476950 -1.249086 -0.168922
C 1.842389 0.414555 -2.044156
C 3.464727 -0.496757 -0.385659
C -0.382858 -2.568647 0.484934
H -3.126400 -2.117617 -0.253856
H 2.282451 -0.162435 -2.878163
H 2.319007 1.416024 -2.008404
H 0.762738 0.530589 -2.242268
H 3.498211 -0.856882 0.656445
H 4.030550 0.455040 -0.467211
H 3.939898 -1.254856 -1.035477
H -0.029716 -2.539934 1.529610
H -1.036223 -3.442811 0.336853
H 0.493700 -2.641244 -0.181146
H -0.901526 2.699034 -0.039463
H -2.631032 2.651208 -0.489852


