%chk=000181288.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181288

0 1
O -2.064047 1.153111 0.825771
N -2.482474 -0.637883 -0.484326
C -0.228270 0.442531 -0.599615
C 0.441065 -0.929956 -0.791897
C 0.635051 1.380480 0.266540
C -1.630385 0.354881 0.010906
C 0.309998 -1.837561 0.394905
C 1.849889 1.860569 -0.468303
C 0.135287 -3.153716 0.296046
C 3.087236 1.773895 0.015725
H -0.357857 0.912115 -1.611854
H 1.527760 -0.771015 -0.991368
H 0.054456 -1.411765 -1.712342
H 0.024199 2.261430 0.581750
H 0.902707 0.876897 1.217644
H 0.383792 -1.339573 1.365139
H 1.648108 2.312323 -1.441811
H -2.138464 -1.445085 -0.974631
H -3.389817 -0.748637 -0.052837
H 0.061371 -3.804191 1.156270
H 0.063931 -3.688961 -0.638738
H 3.955717 2.142244 -0.510592
H 3.331147 1.337468 0.973320


%chk=000181288-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181288

0 1
O -2.568237 1.465232 -0.536994
N -2.260087 -0.693793 0.251560
C -0.335144 0.505502 -0.807893
C 0.341501 -0.864353 -1.124038
C 0.462932 1.378212 0.219569
C -1.813062 0.459970 -0.364613
C 0.635430 -1.770521 0.055552
C 1.860969 1.707176 -0.257333
C 0.247276 -3.069444 0.157783
C 3.005771 1.486654 0.437060
H -0.359108 1.079632 -1.755671
H 1.312374 -0.627111 -1.605966
H -0.262838 -1.408912 -1.874567
H -0.111693 2.316781 0.352307
H 0.499331 0.881406 1.207202
H 1.240215 -1.332753 0.863587
H 1.922597 2.181920 -1.250524
H -1.642087 -1.489527 0.427002
H -3.227287 -0.717816 0.575273
H 0.525748 -3.686916 1.019198
H -0.335006 -3.559953 -0.633542
H 3.985160 1.773126 0.037762
H 2.995647 1.025090 1.432991


