%chk=000196776.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196776

0 1
O -4.228275 -1.786919 -0.060485
N 1.386394 1.019999 0.361219
N -2.752102 0.771151 -0.438481
C 0.010697 0.766955 0.068793
C 0.314865 3.073979 -0.460770
C 1.665313 2.468558 0.004515
C -0.644225 1.926426 -0.349620
C -0.719325 -0.450752 0.271112
C -2.044876 1.898672 -0.592141
C 2.405009 0.085645 -0.076030
C -2.119660 -0.388989 -0.013386
C 3.539723 -0.099288 0.748402
C -0.132044 -1.656898 0.744367
C -2.770470 3.126310 -1.037434
C 2.273163 -0.631253 -1.277929
C -2.889736 -1.600617 0.165444
C -0.902005 -2.784474 0.909295
C -2.284511 -2.766238 0.615219
C 4.526082 -1.007887 0.333886
C 3.705627 0.645289 2.031223
C 3.262667 -1.535668 -1.663688
C 4.391092 -1.720884 -0.858943
C -5.065614 -0.697135 -0.520477
H 0.367915 3.461871 -1.493460
H 0.010496 3.918507 0.183610
H 2.447062 2.559306 -0.772081
H 2.037782 2.960805 0.925312
H 0.931028 -1.669740 0.982440
H -2.356100 3.512122 -1.979003
H -3.842204 2.933660 -1.204610
H -2.695950 3.922714 -0.283685
H 1.391521 -0.488478 -1.903571
H -0.459149 -3.712017 1.271877
H -2.884771 -3.665539 0.743869
H 5.407448 -1.161745 0.955342
H 4.113761 1.650153 1.854960
H 2.740657 0.776322 2.549243
H 4.379049 0.133774 2.730360
H 3.154412 -2.094981 -2.591453
H 5.165564 -2.424019 -1.161134
H -4.721931 -0.341198 -1.496509
H -5.069226 0.113895 0.214381
H -6.041253 -1.191895 -0.586878


%chk=000196776-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196776

0 1
O -4.367564 -1.644521 0.097028
N 1.396067 0.953778 0.161419
N -2.813490 0.819806 -0.298597
C 0.010133 0.733236 0.025790
C 0.339566 3.067627 -0.424507
C 1.664766 2.434066 0.103808
C -0.661049 1.931193 -0.281326
C -0.737222 -0.479927 0.251826
C -2.072497 1.947179 -0.438714
C 2.439128 0.019792 -0.152076
C -2.178373 -0.367707 0.039551
C 3.626847 -0.020336 0.640807
C -0.165353 -1.701629 0.721496
C -2.804843 3.228295 -0.781632
C 2.301642 -0.841165 -1.274331
C -2.981783 -1.557397 0.244041
C -0.986681 -2.810920 0.949471
C -2.381660 -2.744912 0.698358
C 4.653793 -0.920621 0.260681
C 3.778047 0.837550 1.883242
C 3.329740 -1.740208 -1.620517
C 4.518908 -1.775470 -0.855540
C -5.130047 -0.757261 -0.800222
H 0.431018 3.388193 -1.481257
H 0.059463 3.960058 0.162392
H 2.527391 2.630127 -0.555896
H 1.905357 2.814495 1.114518
H 0.908271 -1.766392 0.911436
H -2.403226 3.690918 -1.703625
H -3.874215 3.012124 -0.929026
H -2.705735 3.977940 0.027353
H 1.382740 -0.796007 -1.868119
H -0.553440 -3.746364 1.319534
H -3.028071 -3.613416 0.857122
H 5.566773 -0.962311 0.867211
H 4.044500 1.883747 1.637403
H 2.833388 0.868360 2.456110
H 4.572709 0.442073 2.538557
H 3.207824 -2.399104 -2.487168
H 5.327144 -2.465943 -1.119907
H -4.629244 -0.657276 -1.779330
H -5.245005 0.243846 -0.360508
H -6.101816 -1.266018 -0.913759


