%chk=000228111.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228111

0 1
O -3.056070 3.113681 -0.266479
O -0.904032 3.048035 -0.135849
O -4.844628 -2.766816 0.107562
O -5.760289 -0.817612 -0.104376
N 1.467942 -0.014505 0.264929
N 0.359971 0.810670 0.131838
N -2.012104 2.499383 -0.154205
N -4.791380 -1.550660 0.012481
C 3.842836 -0.504641 0.462710
C 4.837393 -0.308459 -0.732483
C 2.671807 0.489627 0.279337
C 4.517463 -0.136464 1.797822
C 3.343812 -1.954119 0.538837
C 4.145257 -0.522746 -2.082786
C 6.062529 -1.220825 -0.616538
C 3.008827 1.944766 0.165504
C -0.886312 0.233077 0.101761
C -2.059450 1.054187 -0.036510
C -1.064378 -1.190974 0.205714
C -3.337170 0.450157 -0.063470
C -2.309068 -1.754282 0.176902
C -3.465260 -0.925734 0.040780
H 5.200560 0.752628 -0.693674
H 4.978871 0.855402 1.778961
H 3.799054 -0.153991 2.626094
H 5.307399 -0.855578 2.048433
H 2.816319 -2.249370 -0.376838
H 2.642449 -2.097621 1.370262
H 4.173748 -2.653845 0.683997
H 3.305270 0.163883 -2.230258
H 4.843415 -0.365571 -2.913166
H 3.753096 -1.542268 -2.181650
H 6.777000 -1.019708 -1.423658
H 6.592802 -1.076073 0.330753
H 5.791225 -2.280807 -0.685607
H 4.083681 2.115106 -0.011893
H 2.485642 2.439296 -0.666790
H 2.753835 2.489058 1.088428
H 0.455147 1.852989 0.058331
H -0.169616 -1.815816 0.310081
H -4.233733 1.088808 -0.169127
H -2.451359 -2.840471 0.256340


%chk=000228111-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228111

0 1
O -3.017835 3.219036 -0.210295
O -0.750324 3.052720 -0.070080
O -4.992836 -2.734846 0.031341
O -5.880257 -0.635910 -0.146906
N 1.470049 -0.145991 0.272165
N 0.376379 0.716941 0.145753
N -1.950327 2.507949 -0.105957
N -4.879445 -1.446896 -0.039060
C 3.877844 -0.520621 0.475925
C 4.835041 -0.316810 -0.774883
C 2.665863 0.415693 0.315457
C 4.612819 -0.108462 1.792126
C 3.425851 -1.996324 0.612833
C 4.141333 -0.660997 -2.116371
C 6.169536 -1.093755 -0.660897
C 2.871775 1.920431 0.231912
C -0.895974 0.200687 0.100222
C -2.058337 1.053711 -0.022979
C -1.117250 -1.215741 0.174568
C -3.361129 0.509705 -0.067725
C -2.400898 -1.749304 0.129257
C -3.521595 -0.877629 0.007930
H 5.096241 0.762680 -0.801047
H 5.082631 0.889361 1.719327
H 3.907455 -0.098114 2.642992
H 5.406953 -0.837329 2.028249
H 2.856400 -2.337824 -0.266504
H 2.772607 -2.120613 1.493675
H 4.304823 -2.651495 0.743500
H 3.173566 -0.140062 -2.232638
H 4.787215 -0.370007 -2.964957
H 3.950701 -1.746143 -2.202706
H 6.801627 -0.872318 -1.540810
H 6.747247 -0.816076 0.238016
H 6.005028 -2.186404 -0.642385
H 3.932935 2.194699 0.309890
H 2.491731 2.327296 -0.726664
H 2.332347 2.446756 1.044452
H 0.438656 1.752906 0.083645
H -0.236428 -1.853180 0.267783
H -4.226088 1.171326 -0.160241
H -2.573430 -2.827249 0.184592


