%chk=000234057.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234057

0 1
O -4.428033 -0.352327 -0.021660
N -0.786396 -0.425242 0.291717
N 2.058634 0.084835 0.378765
N -8.869319 -0.896311 -1.622235
C -0.205402 0.825362 -0.300544
C 0.050526 -0.875404 1.452828
C 1.229766 0.543181 -0.786865
C 1.482194 -1.170586 0.960680
C -2.210919 -0.216114 0.699208
C 3.464445 -0.032595 0.014616
C -3.083488 -0.623177 -0.499061
C 4.288481 1.100971 0.222911
C 4.020497 -1.218550 -0.492708
C 5.654470 1.007737 -0.081893
C 3.738434 2.385797 0.749814
C 5.384460 -1.291843 -0.782740
C 6.201887 -0.177865 -0.578371
C -5.459394 -0.746381 -0.953231
C -6.746858 -0.363481 -0.209752
C -7.925892 -0.660984 -0.997675
H -0.195974 1.676245 0.415813
H -0.833280 1.127314 -1.165383
H -0.392589 -1.808076 1.862882
H 0.083954 -0.129073 2.276339
H 1.211165 -0.202314 -1.611843
H 1.678021 1.475517 -1.191563
H 2.116806 -1.478628 1.819248
H 1.459300 -2.016392 0.238545
H -2.450956 0.824681 1.005543
H -2.476763 -0.853672 1.570514
H -2.980727 -1.693971 -0.742098
H -2.889794 -0.013130 -1.396230
H 3.389035 -2.088226 -0.666105
H 6.298688 1.871802 0.074443
H 4.479944 2.952322 1.325915
H 3.389371 3.029417 -0.068928
H 2.873645 2.212170 1.412314
H 5.807127 -2.216311 -1.170817
H 7.264775 -0.231425 -0.804980
H -5.338216 -0.186686 -1.897279
H -5.392161 -1.832112 -1.143131
H -6.712342 0.721550 0.057875
H -6.781824 -0.895827 0.772620


%chk=000234057-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000234057

0 1
O -4.478716 -0.361414 0.134936
N -0.750959 -0.617576 0.319819
N 2.109173 -0.169803 0.243894
N -8.948088 -0.309021 -1.778339
C -0.187125 0.645972 -0.217819
C 0.148778 -1.179324 1.357938
C 1.215976 0.402128 -0.796155
C 1.552953 -1.430987 0.778558
C -2.154806 -0.482519 0.773795
C 3.524120 -0.090400 0.026649
C -3.128674 -0.575806 -0.409775
C 4.175914 1.188322 0.005978
C 4.310070 -1.269857 -0.113617
C 5.576431 1.229150 -0.198282
C 3.418258 2.478294 0.268212
C 5.706635 -1.200725 -0.299525
C 6.348005 0.055704 -0.357173
C -5.518871 -0.456964 -0.885421
C -6.847371 -0.197332 -0.143499
C -8.011133 -0.257684 -1.041300
H -0.118494 1.430136 0.579184
H -0.846599 1.030073 -1.017211
H -0.273450 -2.138432 1.711080
H 0.244397 -0.494615 2.238038
H 1.133760 -0.297029 -1.661238
H 1.635268 1.349543 -1.167767
H 2.215227 -1.805328 1.579041
H 1.472381 -2.218016 -0.009267
H -2.340696 0.472440 1.321767
H -2.385386 -1.305815 1.473911
H -3.053304 -1.575408 -0.886307
H -2.907982 0.195442 -1.179539
H 3.822905 -2.250199 -0.095271
H 6.074702 2.207000 -0.203707
H 4.081004 3.228073 0.734639
H 3.019155 2.934730 -0.659677
H 2.561860 2.293607 0.941771
H 6.286505 -2.124414 -0.409057
H 7.431278 0.122884 -0.504966
H -5.362460 0.300405 -1.683625
H -5.522999 -1.464178 -1.354649
H -6.801456 0.796390 0.338797
H -6.960890 -0.945251 0.662676


