%chk=000265593.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265593

0 1
O 0.708468 2.412065 -0.887427
N -1.250813 -1.633783 -0.390516
C -0.504109 -0.520635 0.274707
C 0.489958 0.028964 -0.783459
C -2.154358 -2.473475 0.452929
C -0.850106 -3.037774 -0.064969
C 1.662506 -0.928557 -1.058241
C -1.505576 0.546610 0.770908
C 1.051160 1.382931 -0.350569
C 2.649107 -1.007875 0.113161
C 2.071691 1.371874 0.770691
C 3.199294 0.378667 0.471447
C -2.315775 1.213289 -0.349425
C -3.412817 2.114896 0.211230
H 0.085175 -0.873751 1.162932
H -0.078902 0.176147 -1.741752
H -3.102448 -2.744924 -0.021257
H -2.284927 -2.278638 1.517386
H -0.032518 -3.251281 0.623488
H -0.845768 -3.724866 -0.916087
H 2.192757 -0.591686 -1.971970
H 1.272314 -1.936002 -1.301003
H -0.961808 1.322975 1.343264
H -2.201094 0.079259 1.496090
H 3.483536 -1.687143 -0.145963
H 2.154687 -1.457795 0.995415
H 2.482240 2.392381 0.913030
H 1.567640 1.114910 1.722582
H 3.820925 0.763954 -0.361787
H 3.874745 0.307336 1.345157
H -1.638575 1.809785 -0.997997
H -2.759306 0.437105 -1.005245
H -4.132496 1.554088 0.816606
H -2.998682 2.912413 0.838521
H -3.971825 2.598135 -0.598775


%chk=000265593-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000265593

0 1
O 0.846624 2.533969 -0.765412
N -1.262215 -1.603937 -0.347915
C -0.543375 -0.448965 0.280346
C 0.488327 0.110203 -0.757309
C -2.018838 -2.498051 0.604462
C -0.740741 -2.990252 -0.051175
C 1.629658 -0.893402 -1.115393
C -1.587187 0.614562 0.713678
C 1.124372 1.413555 -0.255680
C 2.639016 -1.102092 0.038355
C 2.151518 1.273194 0.867147
C 3.255655 0.243263 0.486690
C -2.426487 1.226250 -0.433076
C -3.558161 2.128258 0.103734
H 0.001445 -0.780510 1.201954
H -0.080499 0.346222 -1.674265
H -2.994632 -2.844076 0.249594
H -1.969882 -2.274226 1.679882
H 0.142528 -3.088850 0.596134
H -0.782815 -3.697155 -0.886400
H 2.175756 -0.493002 -1.993508
H 1.184301 -1.851749 -1.435084
H -1.064387 1.428389 1.256487
H -2.272047 0.141806 1.447837
H 3.440381 -1.791943 -0.289323
H 2.142412 -1.585665 0.903949
H 2.578598 2.266821 1.086708
H 1.631380 0.913831 1.779694
H 3.866720 0.660247 -0.338504
H 3.934315 0.095863 1.348000
H -1.769911 1.822381 -1.093960
H -2.847564 0.406467 -1.045188
H -4.256345 1.556896 0.745496
H -3.149506 2.960770 0.707940
H -4.144114 2.570525 -0.722792


