%chk=000230284.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230284

0 1
O 2.035223 -1.834092 -0.055449
N 2.494997 -0.620667 -0.086471
N -1.211636 2.261721 -0.376123
C 1.779607 0.204508 -1.187200
C 0.484189 0.780729 -0.755125
C -0.655512 0.041623 -0.263956
C -1.706789 0.990160 -0.039144
C 0.122066 2.121198 -0.810457
C 2.340619 0.054871 1.269421
C 3.986428 -0.647938 -0.434770
C -0.880679 -1.320244 0.017603
C -2.973552 0.599416 0.443074
C -2.124102 -1.698799 0.489249
C -3.159651 -0.747918 0.696335
H 1.592868 -0.510195 -2.029720
H 2.456638 0.996577 -1.564756
H 0.699641 2.969963 -1.127489
H 2.926382 -0.486695 2.026896
H 2.635150 1.108024 1.246856
H 1.283830 -0.015320 1.590600
H 4.127194 -1.099954 -1.428827
H 4.446626 0.343175 -0.406078
H 4.507960 -1.314410 0.272564
H -1.721396 3.120832 -0.337767
H -0.055386 -2.035782 -0.126115
H -3.759728 1.326911 0.604612
H -2.324825 -2.744580 0.713398
H -4.121261 -1.100916 1.067637


%chk=000230284-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230284

0 1
O 2.060040 -1.862218 0.184384
N 2.598714 -0.553176 -0.013826
N -1.237224 2.232955 -0.316365
C 1.781446 0.208774 -1.120410
C 0.456270 0.740358 -0.677881
C -0.726797 0.002560 -0.252253
C -1.773368 0.965836 -0.036780
C 0.100309 2.092660 -0.698622
C 2.586788 0.208698 1.301539
C 4.031372 -0.693836 -0.514373
C -0.989167 -1.374893 -0.019772
C -3.071379 0.595859 0.381635
C -2.283601 -1.748352 0.389403
C -3.312376 -0.777923 0.586189
H 1.678929 -0.572107 -1.893254
H 2.412391 1.033307 -1.505228
H 0.698833 2.958032 -0.980723
H 3.215749 -0.360588 2.001976
H 2.960503 1.242570 1.179849
H 1.549245 0.213121 1.660388
H 3.985883 -1.210554 -1.484700
H 4.534576 0.286197 -0.613607
H 4.554441 -1.336270 0.208408
H -1.747087 3.112071 -0.265897
H -0.164415 -2.088688 -0.121195
H -3.860556 1.338805 0.544371
H -2.507883 -2.804795 0.575067
H -4.306734 -1.106205 0.910476


