%chk=000179388.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179388

0 1
O -2.319850 -2.979066 0.156019
N -1.387864 -2.240083 0.118042
C 0.574394 2.189322 -0.092738
C -0.749551 1.462950 -0.055026
C -0.534580 0.044967 0.009662
C 1.581016 1.063782 -0.044221
C 0.913201 -0.199179 0.016113
C -1.634584 -0.812329 0.052975
C -2.023993 1.994159 -0.075375
C 2.963830 1.137011 -0.052145
C 1.645442 -1.378464 0.067840
C -2.940067 -0.255829 0.031638
C -3.129346 1.115939 -0.031182
C 3.695735 -0.063367 0.000626
C 3.048617 -1.298304 0.059499
H 0.689749 2.881212 0.763825
H 0.684066 2.799662 -1.009883
H -2.185929 3.069610 -0.124459
H 3.478525 2.092722 -0.097809
H 1.145495 -2.347397 0.113926
H -3.793509 -0.937806 0.066136
H -4.137165 1.529343 -0.047063
H 4.784692 -0.022761 -0.004816
H 3.634176 -2.215696 0.099715


%chk=000179388-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179388

0 1
O -2.422051 -2.991964 0.156871
N -1.375101 -2.239973 0.118948
C 0.582368 2.211807 -0.093316
C -0.749377 1.475454 -0.055275
C -0.526519 0.062482 0.009326
C 1.595021 1.076592 -0.044458
C 0.924610 -0.186867 0.015975
C -1.650116 -0.813044 0.053197
C -2.050506 1.998475 -0.075660
C 2.999230 1.141073 -0.052544
C 1.665927 -1.393461 0.068826
C -2.970939 -0.275333 0.032207
C -3.167276 1.113423 -0.031500
C 3.738740 -0.065788 0.000034
C 3.075382 -1.319259 0.060066
H 0.693740 2.904811 0.763588
H 0.688466 2.823510 -1.010627
H -2.214268 3.081202 -0.125120
H 3.517919 2.105392 -0.098815
H 1.141313 -2.351182 0.115163
H -3.811786 -0.976544 0.067212
H -4.182890 1.523071 -0.047276
H 4.834012 -0.032776 -0.005674
H 3.666602 -2.240701 0.100153


