%chk=000207894.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207894

0 1
O -1.048629 -1.100242 -1.680374
O -1.815787 -0.964892 1.603914
O 4.644691 -0.042952 1.300732
N -4.069606 0.837271 1.407725
N 4.422363 -0.176703 -1.021933
N 6.500352 0.358029 0.013379
C -3.818700 -0.234201 0.401378
C -2.296411 -0.483726 0.335360
C -3.936047 2.228243 0.870685
C -1.919351 -1.607930 -0.642597
C -5.036929 2.600995 -0.135800
C -3.949199 3.186812 2.068527
C 0.288631 -0.890725 -1.382333
C 1.048403 -0.562524 -2.521485
C 0.864788 -0.967145 -0.109668
C 3.004365 -0.396161 -1.096459
C 2.407723 -0.311957 -2.374068
C 2.229948 -0.719473 0.030845
C 5.129837 0.026051 0.184501
H -4.206416 0.001780 -0.612886
H -4.329070 -1.164407 0.735441
H -1.743281 0.454283 0.092773
H -2.939287 2.299099 0.359028
H -4.993313 0.704988 1.830825
H -2.767547 -1.976797 -1.247377
H -1.444197 -2.455811 -0.111848
H -6.035906 2.553074 0.309017
H -4.900374 3.623981 -0.504550
H -5.029316 1.940908 -1.009388
H -3.198050 2.893147 2.814007
H -4.918747 3.205207 2.576866
H -3.721222 4.210719 1.754501
H -2.167531 -0.393216 2.329910
H 0.563921 -0.509132 -3.494045
H 0.263428 -1.204008 0.774269
H 3.000856 -0.055161 -3.249361
H 2.689954 -0.769627 1.025777
H 4.876849 0.054707 -1.905786
H 7.009453 0.056390 -0.800971
H 7.053953 0.351000 0.863969


%chk=000207894-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207894

0 1
O -0.830947 -0.954781 -1.845548
O -1.605818 0.142093 1.251198
O 5.004640 -0.186780 1.376103
N -4.153585 0.812653 1.401754
N 4.746605 -0.455565 -0.960759
N 6.875469 -0.215032 -0.006117
C -3.830327 -0.136902 0.309501
C -2.310454 -0.006745 -0.021776
C -4.399491 2.238396 1.026069
C -1.804299 -1.246630 -0.783141
C -5.712981 2.445084 0.228313
C -4.383371 3.097578 2.306229
C 0.536323 -0.816424 -1.513271
C 1.425683 -0.878444 -2.612610
C 1.039003 -0.617195 -0.206238
C 3.329523 -0.567641 -1.090103
C 2.809399 -0.751706 -2.401052
C 2.431107 -0.498793 0.004968
C 5.493297 -0.281064 0.210677
H -4.430511 0.006484 -0.614789
H -4.027531 -1.158988 0.686197
H -2.140220 0.884741 -0.664059
H -3.546712 2.544194 0.388903
H -4.880896 0.461593 2.038219
H -2.638832 -1.714483 -1.337082
H -1.392722 -1.972374 -0.054413
H -6.591211 2.207518 0.859138
H -5.808423 3.495096 -0.104266
H -5.750634 1.804792 -0.671565
H -3.425003 2.983423 2.841504
H -5.200679 2.796459 2.990681
H -4.526611 4.165415 2.063051
H -2.315583 0.552412 1.849722
H 1.018672 -1.031608 -3.616726
H 0.355859 -0.508553 0.642573
H 3.490909 -0.803830 -3.260944
H 2.826708 -0.343461 1.010412
H 5.261230 -0.516115 -1.841227
H 7.323202 -0.287901 -0.916970
H 7.453811 -0.087023 0.819946


