%chk=000231599.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231599

0 1
O 1.722280 2.557683 0.211864
N 1.652059 0.308691 0.582013
N 2.770318 -1.096710 -2.359126
C -0.330355 1.683998 1.130424
C -1.250402 0.602680 0.643143
C 1.077065 1.591381 0.574389
C -1.577717 0.526966 -0.719885
C -1.785865 -0.330137 1.542561
C -2.433582 -0.477779 -1.176251
C -2.644946 -1.331292 1.079012
C -2.968556 -1.408495 -0.278654
C 2.975436 0.096460 -0.036862
C 2.859947 -0.569884 -1.336017
H -0.744130 2.684846 0.854398
H -0.274295 1.708288 2.241434
H -1.165435 1.251139 -1.422210
H -1.543073 -0.275504 2.601837
H -2.684430 -0.536215 -2.235372
H -3.063445 -2.052515 1.780087
H 1.088674 -0.522404 0.748434
H -3.636173 -2.189944 -0.637579
H 3.613073 -0.514467 0.652373
H 3.492853 1.092416 -0.166514


%chk=000231599-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231599

0 1
O 2.034078 2.368070 1.131720
N 1.511190 0.290450 0.229099
N 3.446758 -0.476597 -2.595660
C -0.345355 1.786549 0.952496
C -1.286367 0.651238 0.585499
C 1.165103 1.515139 0.783498
C -1.710971 0.464687 -0.757435
C -1.744321 -0.259161 1.573980
C -2.568468 -0.604435 -1.103486
C -2.603204 -1.328192 1.231774
C -3.016804 -1.505096 -0.109294
C 2.916761 -0.052096 -0.010679
C 3.212593 -0.279221 -1.442750
H -0.552953 2.687753 0.345686
H -0.478203 2.091714 2.006225
H -1.375536 1.165110 -1.532376
H -1.430839 -0.124205 2.616502
H -2.888820 -0.730904 -2.143487
H -2.951815 -2.017802 2.008547
H 0.773255 -0.362568 -0.044781
H -3.684521 -2.331657 -0.375767
H 3.214660 -0.952410 0.560200
H 3.513081 0.802834 0.363988