%chk=000277521.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277521

0 1
O 2.940811 -0.163136 -1.087637
O -2.981284 1.206108 0.162874
O 3.226966 0.315957 1.004400
O -1.175115 2.220529 0.792209
N 2.576872 0.298846 -0.021242
N -1.803573 1.479953 0.057166
C 0.152733 0.017811 -0.650489
C -0.246130 -1.145981 0.272434
C 1.199568 0.919366 0.032978
C -1.058771 0.853717 -1.102564
C -1.138026 -2.178181 -0.431348
C -1.433105 -3.367407 0.478472
H 0.614169 -0.408251 -1.587950
H -0.752400 -0.772990 1.184795
H 0.670063 -1.652790 0.642842
H 1.249308 1.922378 -0.450927
H 0.925114 1.134010 1.096651
H -1.769711 0.209613 -1.675722
H -0.741420 1.664839 -1.796507
H -2.092833 -1.709115 -0.743870
H -0.648399 -2.533764 -1.359977
H -1.949524 -3.060229 1.396072
H -0.517102 -3.890751 0.777629
H -2.075813 -4.100033 -0.024688


%chk=000277521-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000277521

0 1
O 2.942373 -0.415878 -0.979609
O -3.027545 0.951209 0.239018
O 3.283286 0.401452 1.121350
O -1.310095 2.375480 0.721826
N 2.577898 0.252458 0.059373
N -1.864100 1.448812 0.016454
C 0.155820 0.056333 -0.658034
C -0.243618 -1.137254 0.250215
C 1.215890 0.955739 0.015881
C -1.053091 0.888776 -1.148294
C -1.197719 -2.157227 -0.414351
C -1.418613 -3.402831 0.470658
H 0.618901 -0.347398 -1.581626
H -0.699172 -0.759663 1.188661
H 0.683463 -1.667195 0.545932
H 1.388882 1.887564 -0.552459
H 0.976940 1.216839 1.056628
H -1.749320 0.274161 -1.736183
H -0.725219 1.761439 -1.738947
H -2.177616 -1.683779 -0.618077
H -0.777175 -2.469093 -1.392408
H -1.852608 -3.122029 1.448317
H -0.465479 -3.929953 0.662547
H -2.109686 -4.117463 -0.011272


