%chk=000259542.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259542

0 1
O 4.618868 0.426119 -0.040616
O -5.537148 -0.455829 0.307635
N -0.027254 0.529009 0.144211
N 1.906475 1.790650 0.204802
N 1.040490 -1.740922 -0.109876
N 3.479699 -1.624390 -0.201177
N -4.623782 1.929063 -0.790126
C -1.436288 0.241888 0.147693
C 1.041605 -0.371464 0.022596
C 2.240470 0.436842 0.055906
C 0.575261 1.836131 0.254944
C -2.319896 1.248846 -0.285336
C -1.897531 -1.004405 0.590378
C -3.701535 0.998193 -0.276233
C 3.472503 -0.266114 -0.064212
C -4.160811 -0.270437 0.187430
C -3.274168 -1.256709 0.604457
C 2.272442 -2.290532 -0.217272
C 5.887221 -0.339646 -0.169721
C 6.926156 0.756017 -0.101238
C -6.122125 -1.179063 -0.809152
H -0.029300 2.725028 0.379054
H -1.946232 2.198254 -0.659107
H -1.200353 -1.782609 0.910891
H -3.656488 -2.216862 0.953113
H 2.329775 -3.386923 -0.328520
H 5.935189 -1.056398 0.667281
H 5.861779 -0.874261 -1.134175
H -5.586511 1.785813 -0.498131
H -4.348415 2.899852 -0.763752
H 7.940341 0.347017 -0.182814
H 6.790297 1.491833 -0.907429
H 6.860229 1.316015 0.843182
H -5.960731 -0.628712 -1.740378
H -7.182755 -1.207316 -0.535990
H -5.701375 -2.186379 -0.865416


%chk=000259542-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259542

0 1
O 4.647088 0.456949 0.104244
O -5.606410 -0.233988 -0.323557
N -0.021844 0.579976 0.091027
N 1.906516 1.790108 0.485412
N 1.017749 -1.600464 -0.541298
N 3.465615 -1.507491 -0.498896
N -4.592582 2.181693 -0.794799
C -1.432831 0.316457 -0.024556
C 1.052225 -0.292738 -0.151416
C 2.233866 0.481218 0.090701
C 0.564619 1.805226 0.473948
C -2.297915 1.383484 -0.376098
C -1.940430 -0.976033 0.220294
C -3.694737 1.175836 -0.459762
C 3.466138 -0.203122 -0.106038
C -4.204537 -0.139667 -0.201376
C -3.335130 -1.194864 0.123123
C 2.259949 -2.132945 -0.693887
C 5.911916 -0.313221 -0.114206
C 7.050763 0.646439 0.211909
C -6.214635 -1.545232 -0.098717
H -0.042610 2.658133 0.766534
H -1.890707 2.371300 -0.618025
H -1.262568 -1.797587 0.456596
H -3.725573 -2.199532 0.309826
H 2.308060 -3.178751 -1.010443
H 5.898200 -1.201768 0.541822
H 5.931396 -0.661226 -1.162534
H -5.581250 1.953389 -0.852303
H -4.278652 3.125357 -0.995264
H 8.020996 0.136378 0.068773
H 7.020559 1.531622 -0.445938
H 6.987528 0.990689 1.258175
H -5.836002 -2.290492 -0.824790
H -7.294258 -1.396637 -0.247863
H -6.024409 -1.900897 0.932285


