%chk=000223776.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223776

0 1
O -0.505167 -3.832278 1.740632
O -3.097416 2.118875 -0.664219
O 0.919339 2.896475 0.436749
O -1.151367 1.437282 -1.672247
O 2.695313 1.869258 1.445347
N -1.171442 -0.712102 0.117172
N 2.087780 -0.318080 -0.257370
N -2.157910 0.244125 0.112229
N 1.602659 0.958756 -0.470923
C -0.006250 -3.416095 -0.528972
C 1.433362 -3.760087 -0.924087
C -0.131164 -2.761204 0.852170
C 2.440807 -2.601427 -0.850633
C -1.260653 -1.734331 0.909884
C 1.831334 -1.251649 -1.126645
C -2.012037 1.275058 -0.838474
C 1.848333 1.861287 0.587782
C -3.119320 3.277230 -1.547535
C 1.164382 4.067738 1.257861
H -0.617018 -4.347175 -0.525118
H -0.458588 -2.764768 -1.304566
H 1.418423 -4.168081 -1.955713
H 1.801151 -4.586860 -0.281196
H 0.821753 -2.303847 1.207061
H 2.942970 -2.603515 0.143553
H 3.260755 -2.772399 -1.581498
H -2.057072 -1.980194 1.623555
H 1.215647 -1.172342 -2.030839
H -0.230263 -3.639275 2.657242
H -2.961524 0.241618 0.750903
H 0.752790 1.117888 -1.059999
H -4.014833 3.807235 -1.203747
H -3.210459 2.942879 -2.586072
H -2.208299 3.868617 -1.404106
H 2.000068 4.629208 0.828758
H 1.383969 3.771972 2.290283
H 0.220249 4.615607 1.180275


%chk=000223776-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223776

0 1
O -0.534794 -4.011440 1.757816
O -2.994773 2.155834 -0.559411
O 0.798628 2.977050 0.218952
O -1.158907 1.285014 -1.744764
O 2.441425 1.894992 1.518516
N -1.205663 -0.852712 0.057799
N 2.063574 -0.338760 -0.196192
N -2.089443 0.210612 0.145872
N 1.445002 0.894585 -0.395377
C -0.004149 -3.423808 -0.552861
C 1.432430 -3.793003 -0.993379
C -0.145038 -2.880439 0.888418
C 2.478416 -2.633463 -0.871166
C -1.180761 -1.762734 0.994115
C 1.897029 -1.258702 -1.116554
C -1.996137 1.213268 -0.812945
C 1.655845 1.890366 0.546004
C -2.941941 3.352488 -1.430009
C 0.970552 4.153058 1.093444
H -0.655721 -4.315626 -0.617852
H -0.412167 -2.667540 -1.245016
H 1.378025 -4.126816 -2.048316
H 1.801624 -4.658436 -0.410744
H 0.824445 -2.458717 1.229922
H 2.937597 -2.618723 0.133905
H 3.300559 -2.831294 -1.588964
H -1.837451 -1.761798 1.886893
H 1.313322 -1.087572 -2.041110
H -0.215100 -3.849464 2.681059
H -2.784024 0.311987 0.898545
H 0.698551 1.030166 -1.105006
H -3.745524 4.003442 -1.058526
H -3.116717 3.067595 -2.480687
H -1.955791 3.838245 -1.341040
H 1.994713 4.555022 1.006884
H 0.780143 3.888400 2.147692
H 0.232524 4.884320 0.731578


