%chk=000245981.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245981

0 1
O 2.541855 0.595786 0.105901
N 0.393631 -0.259271 0.258869
N -1.686323 0.856140 0.003723
N 0.281292 2.179049 0.178366
N -2.905856 -1.368584 -0.112762
C -0.255053 0.887028 0.142770
C 1.812618 -0.379095 0.224787
C 2.284040 -1.787534 0.345484
C -2.329843 -0.368188 -0.021142
H 1.951273 -2.242858 1.293102
H 1.866283 -2.422965 -0.453365
H 3.380970 -1.846702 0.298858
H -2.226038 1.618699 0.433954
H -0.216636 2.963648 -0.214190
H 1.309888 2.245746 0.115643


%chk=000245981-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245981

0 1
O 2.516665 0.676069 0.223092
N 0.356060 -0.327526 0.186093
N -1.681895 0.822693 0.061750
N 0.320202 2.082213 0.085364
N -3.078551 -1.315487 0.100976
C -0.270307 0.848923 0.113618
C 1.757939 -0.365723 0.239152
C 2.332975 -1.761467 0.320465
C -2.394327 -0.333943 0.084116
H 1.954682 -2.268498 1.226149
H 1.988780 -2.359521 -0.541827
H 3.431751 -1.721957 0.341313
H -2.199791 1.702709 0.003536
H -0.193064 2.960957 0.030425
H 1.360981 2.031457 0.125774


