%chk=000217945.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217945

0 1
O -4.050707 0.405605 0.046701
O -0.006371 2.616140 0.050072
N 0.092147 0.317771 0.026743
N -0.173047 -2.199534 0.008531
N -2.040230 1.503752 0.040544
C -0.628153 -0.887699 0.020076
C -2.046114 -0.909102 0.025605
C -2.844359 0.290283 0.037269
C -0.627898 1.572819 0.038565
C -2.453100 -2.280564 0.017079
C -1.309270 -3.058251 0.006626
C 1.547017 0.349053 0.021961
C 1.216854 -2.664445 0.000051
C -2.745992 2.815883 0.031607
C 2.227965 0.372755 -1.204380
C 2.236265 0.363644 1.243783
C 3.624983 0.397108 -1.197974
C 3.633215 0.388133 1.228077
C 4.326270 0.400177 0.012718
H -3.475312 -2.615071 0.018709
H -1.202056 -4.125769 -0.001765
H 1.762585 -2.307405 0.894657
H 1.259311 -3.768051 -0.003462
H 1.753411 -2.301868 -0.897861
H -3.806635 2.668292 0.312053
H -2.707990 3.267168 -0.973848
H -2.278557 3.514198 0.747109
H 1.675127 0.392666 -2.143378
H 1.689752 0.376575 2.186631
H 4.168636 0.424453 -2.142554
H 4.183249 0.408490 2.169142
H 5.415506 0.424695 0.009113


%chk=000217945-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217945

0 1
O -4.101686 0.389008 0.048794
O 0.027143 2.638732 0.015393
N 0.079437 0.296948 0.021129
N -0.192040 -2.209669 0.018997
N -2.019744 1.499070 0.034762
C -0.652125 -0.898502 0.024316
C -2.064229 -0.916187 0.032433
C -2.838329 0.307861 0.037343
C -0.608899 1.548173 0.025911
C -2.482059 -2.292187 0.034269
C -1.327500 -3.063286 0.025746
C 1.534689 0.353901 0.013476
C 1.190339 -2.719002 0.007878
C -2.700527 2.814249 0.039067
C 2.224271 0.396933 -1.217430
C 2.236513 0.386186 1.237836
C 3.636122 0.448690 -1.221552
C 3.648376 0.437835 1.228575
C 4.349192 0.463679 0.000081
H -3.511038 -2.642726 0.040489
H -1.193675 -4.142557 0.023814
H 1.750663 -2.387915 0.897492
H 1.146512 -3.819376 0.009325
H 1.735684 -2.389547 -0.891669
H -3.782014 2.615005 0.061665
H -2.431685 3.386321 -0.864336
H -2.392780 3.398192 0.921702
H 1.658140 0.404779 -2.154593
H 1.679548 0.385713 2.180524
H 4.176491 0.486406 -2.173443
H 4.198079 0.467072 2.175409
H 5.443634 0.508104 -0.005201


