%chk=000213865.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213865

0 1
O -4.110346 -0.901645 0.127780
N -0.473241 1.398327 -0.695121
N -3.445972 1.217654 0.314924
N 3.743342 -0.356128 0.259689
C -0.611971 0.096824 -0.199784
C 0.703233 -0.494027 -0.192843
C 1.624858 0.501202 -0.691880
C -1.550561 2.393599 -0.796176
C 0.894479 1.643375 -0.974599
C -1.744382 -0.630806 0.231319
C 3.086991 0.314059 -0.915922
C -2.467803 2.306890 0.445427
C 0.875285 -1.809496 0.261580
C -3.144682 -0.150766 0.211429
C -1.526174 -1.943623 0.657971
C -0.239764 -2.520946 0.684196
C 3.617836 0.473911 1.493875
C 5.183432 -0.612168 -0.047520
H -2.139101 2.208309 -1.727790
H -1.115490 3.413145 -0.886519
H 1.226951 2.588635 -1.359808
H 3.223194 -0.361808 -1.796452
H 3.564384 1.283593 -1.183363
H -1.851058 2.156459 1.365343
H -3.008324 3.269753 0.580290
H 1.878984 -2.242339 0.281241
H -4.428222 1.479838 0.237585
H -2.386638 -2.542225 0.977465
H -0.131076 -3.543989 1.038735
H 4.066764 -0.071085 2.338924
H 2.546348 0.604355 1.725648
H 4.081247 1.468414 1.434377
H 5.785670 0.286238 -0.244649
H 5.253333 -1.278421 -0.922016
H 5.636475 -1.149709 0.801442


%chk=000213865-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213865

0 1
O -4.192598 -0.977969 0.297621
N -0.466015 1.416950 -0.602389
N -3.491779 1.208023 0.222181
N 3.830278 -0.287102 0.287060
C -0.630674 0.096242 -0.157804
C 0.679981 -0.514898 -0.168064
C 1.630749 0.480338 -0.632110
C -1.521254 2.422661 -0.763133
C 0.896433 1.634291 -0.881264
C -1.791883 -0.635868 0.232979
C 3.106018 0.290168 -0.876889
C -2.558908 2.330802 0.376081
C 0.837712 -1.862055 0.238215
C -3.215967 -0.159977 0.252732
C -1.588997 -1.989769 0.605709
C -0.306215 -2.591785 0.619072
C 3.763469 0.567036 1.488805
C 5.217275 -0.650030 -0.062477
H -2.039625 2.303393 -1.734649
H -1.042880 3.418912 -0.746696
H 1.235525 2.604521 -1.242428
H 3.255769 -0.411865 -1.722715
H 3.550294 1.271081 -1.195476
H -2.022656 2.282337 1.344770
H -3.160589 3.256451 0.375538
H 1.839577 -2.301496 0.263423
H -4.494594 1.410119 0.222496
H -2.480202 -2.563157 0.880963
H -0.209888 -3.636653 0.932582
H 4.244373 0.047938 2.337027
H 2.709076 0.755468 1.751861
H 4.270986 1.557068 1.353036
H 5.850703 0.230492 -0.344341
H 5.216569 -1.355113 -0.913557
H 5.697938 -1.151156 0.796641


