%chk=000296471.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296471

0 1
O 2.737064 -0.358874 0.000677
O 1.942844 1.761101 0.000665
O -3.659896 0.998411 0.000127
N -1.822472 -0.377254 0.000202
N -1.240800 -1.651970 0.000153
N -1.041860 1.968317 0.000657
N -4.059817 -1.269981 -0.000004
C 0.423905 -0.068200 0.000462
C -0.808326 0.632915 0.000413
C 0.085835 -1.473048 0.000213
C 1.715508 0.560260 0.000643
C 4.102972 0.190771 0.000764
C -3.251642 -0.155097 0.000219
C 4.983805 -1.039615 0.000672
H 0.804231 -2.284862 0.000207
H 4.212400 0.815224 -0.902467
H 4.212343 0.815045 0.904126
H -1.987836 2.344012 0.000501
H -0.243954 2.605424 0.000604
H 6.045819 -0.767240 0.000755
H 4.794286 -1.668019 0.881908
H 4.794374 -1.667826 -0.880720
H -5.062783 -1.151109 -0.000134
H -3.688497 -2.212685 -0.000043


%chk=000296471-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296471

0 1
O 2.728828 -0.425722 0.000975
O 1.847528 1.748234 0.000772
O -3.702525 1.114391 -0.000695
N -1.869078 -0.340550 0.000447
N -1.372097 -1.684710 0.000614
N -1.021868 1.944992 0.000698
N -4.022886 -1.220631 -0.000415
C 0.370948 -0.148172 0.000950
C -0.841176 0.601343 0.000676
C -0.030677 -1.527044 0.000857
C 1.671611 0.487846 0.001235
C 4.100187 0.167267 0.000663
C -3.270668 -0.078887 0.000025
C 5.082193 -1.000427 0.000319
H 0.619076 -2.400076 0.001029
H 4.204054 0.808204 -0.893620
H 4.204507 0.808057 0.894999
H -1.974301 2.319046 0.000578
H -0.170069 2.514470 0.000964
H 6.118775 -0.616546 0.000098
H 4.944963 -1.630608 0.895503
H 4.944522 -1.630453 -0.894905
H -5.035909 -1.142161 -0.001124
H -3.538435 -2.122164 -0.000043


