%chk=000182764.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182764

0 1
O 2.183340 1.537722 0.955422
N 3.719196 0.410953 -0.355646
N 4.639762 1.261751 -0.362073
N 5.567761 1.895229 -0.489467
C 0.150363 -0.494598 0.051613
C -0.647026 -1.664960 -0.181070
C -1.890342 0.845793 0.167796
C -2.683098 -0.322678 -0.075669
C -0.493979 0.738852 0.227662
C -2.045375 -1.558664 -0.242941
C 1.594486 -0.654682 0.089572
C 0.000382 -2.944941 -0.344001
C -2.560531 2.114461 0.347914
C -4.121123 -0.189899 -0.137715
C 2.167036 -1.891211 -0.072365
C 1.357676 -3.053999 -0.285862
C -3.918537 2.198052 0.283315
C -4.713748 1.024410 0.034941
C 2.443859 0.542370 0.315896
H 0.095774 1.639385 0.432462
H -2.644021 -2.451880 -0.422940
H -0.628780 -3.820414 -0.512987
H -1.945717 2.994391 0.537326
H -4.710384 -1.086279 -0.325404
H 3.253380 -2.022989 -0.045903
H 1.856814 -4.015260 -0.404370
H -4.433930 3.148289 0.417609
H -5.796038 1.137895 -0.009414


%chk=000182764-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182764

0 1
O 2.191802 1.784325 0.203315
N 3.933467 0.178408 -0.008659
N 4.815849 1.082637 0.094408
N 5.727834 1.827730 0.178017
C 0.158046 -0.446076 -0.053030
C -0.651811 -1.659529 -0.194680
C -1.933145 0.871751 0.123493
C -2.734484 -0.337185 -0.017883
C -0.516090 0.790070 0.102738
C -2.066283 -1.573825 -0.173471
C 1.612428 -0.594342 -0.082472
C -0.007684 -2.934465 -0.355036
C -2.609341 2.133601 0.282350
C -4.171452 -0.232378 0.005544
C 2.182871 -1.869216 -0.241936
C 1.380364 -3.039891 -0.378546
C -3.999662 2.199785 0.300656
C -4.789241 1.004574 0.160705
C 2.515767 0.576161 0.052776
H 0.072062 1.704518 0.209545
H -2.654045 -2.494255 -0.280963
H -0.634421 -3.828315 -0.459108
H -2.006675 3.042876 0.388715
H -4.770382 -1.144650 -0.101187
H 3.272728 -1.954019 -0.260085
H 1.864470 -4.013641 -0.501173
H -4.503657 3.164736 0.422140
H -5.882116 1.077715 0.177525


