%chk=000185042.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185042

0 1
O 1.880084 -2.535755 0.120469
O -0.893405 2.097698 -0.717788
O -4.795763 -0.161821 0.317262
N -2.534062 -0.730871 0.625214
N -3.022666 1.254530 -0.361932
C -1.264372 -0.129972 0.307952
C 1.258653 -0.259185 0.264345
C -0.088523 -0.737401 0.543002
C -1.593884 1.203537 -0.318856
C 2.281516 -1.221725 0.051969
C -3.620087 0.078397 0.208127
C 1.638496 1.090762 0.219550
C 3.610070 -0.870091 -0.209835
C 2.963345 1.459801 -0.034727
C 3.942292 0.486903 -0.252748
H -0.104727 -1.753094 0.981555
H -2.631327 -1.652178 1.025534
H -3.564197 2.026964 -0.737147
H 0.889159 1.873002 0.384200
H 4.367051 -1.629493 -0.376757
H 3.227732 2.515796 -0.068053
H 4.971870 0.783469 -0.456569
H 2.629848 -3.162571 -0.036868


%chk=000185042-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185042

0 1
O 1.917889 -2.570398 0.380558
O -1.041994 2.387084 -0.236233
O -4.878100 -0.296357 0.368048
N -2.540081 -0.793343 0.326796
N -3.140651 1.326038 0.033000
C -1.316939 -0.082971 0.158682
C 1.278646 -0.251876 0.060293
C -0.094492 -0.721642 0.196298
C -1.732180 1.348500 -0.042302
C 2.318782 -1.238162 0.160991
C -3.672041 0.027825 0.258896
C 1.683992 1.099735 -0.164707
C 3.681492 -0.893681 0.045181
C 3.043914 1.445820 -0.280127
C 4.046419 0.452085 -0.175716
H -0.155631 -1.806477 0.364364
H -2.616544 -1.796795 0.483711
H -3.728567 2.153127 -0.064287
H 0.909396 1.868226 -0.245445
H 4.454160 -1.669486 0.126185
H 3.323025 2.490270 -0.451951
H 5.104955 0.719053 -0.265404
H 2.701653 -3.169873 0.441067


