%chk=000231070.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231070

0 1
O -1.487649 -2.641187 1.019334
O -0.879716 1.773931 -0.243425
N 3.304324 0.137403 -0.306765
N -0.829890 -0.476350 0.414405
C 2.666107 -0.922852 -1.152532
C 3.655290 1.378346 -1.075786
C 4.453333 -0.404402 0.514561
C 1.128737 -0.841125 -1.073617
C 0.640312 -0.684761 0.371947
C 2.387501 2.039098 -1.630832
C 4.683727 1.149739 -2.200631
C 3.954074 -1.552864 1.409123
C 5.042418 0.696238 1.411550
C -1.778890 -1.511882 0.722343
C -1.462509 0.770208 0.074833
C -3.125587 -0.852383 0.597766
C -2.937643 0.504957 0.214298
C -4.386258 -1.370352 0.797941
C -4.009774 1.349969 0.029785
C -5.490538 -0.504994 0.607940
C -5.307038 0.820870 0.233700
H 2.973569 -0.847172 -2.219639
H 2.984532 -1.936264 -0.816475
H 4.104552 2.094490 -0.333143
H 5.266097 -0.796242 -0.153072
H 0.766300 0.014491 -1.679576
H 0.693460 -1.748696 -1.533009
H 0.888779 -1.584198 0.977198
H 1.135761 0.197203 0.849739
H 2.586565 3.069837 -1.938268
H 1.980098 1.508198 -2.496491
H 1.590114 2.070627 -0.869594
H 5.632900 0.772324 -1.809757
H 4.893896 2.082809 -2.732825
H 4.320341 0.430189 -2.942354
H 4.760204 -1.937492 2.040969
H 3.144929 -1.215345 2.068481
H 3.563597 -2.392418 0.820274
H 5.523729 1.490701 0.830601
H 5.794025 0.284853 2.092778
H 4.261718 1.165158 2.024743
H -4.533955 -2.409876 1.092701
H -3.869635 2.391112 -0.262893
H -6.497981 -0.894780 0.760643
H -6.170328 1.472784 0.092532


%chk=000231070-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231070

0 1
O -1.577387 -2.828981 0.708141
O -0.909825 1.789971 0.066040
N 3.334183 0.174444 -0.363429
N -0.897663 -0.570859 0.377237
C 2.645364 -0.866168 -1.182289
C 3.746987 1.392397 -1.139741
C 4.393640 -0.389425 0.546879
C 1.093934 -0.815130 -1.120813
C 0.557582 -0.787287 0.326293
C 2.543898 2.068268 -1.834308
C 4.895277 1.140265 -2.162899
C 3.769492 -1.330599 1.606369
C 5.176248 0.715766 1.294835
C -1.854120 -1.612181 0.558194
C -1.518588 0.702956 0.237883
C -3.194468 -0.939141 0.538726
C -2.993589 0.449547 0.346928
C -4.480570 -1.480749 0.677599
C -4.072689 1.343365 0.288127
C -5.580510 -0.584742 0.618598
C -5.379618 0.805682 0.426942
H 2.942434 -0.799070 -2.252005
H 2.977383 -1.866130 -0.846745
H 4.115459 2.115891 -0.390894
H 5.135677 -0.988928 -0.042634
H 0.728924 0.086623 -1.641121
H 0.689484 -1.697166 -1.656543
H 0.757152 -1.741031 0.845794
H 1.059773 0.033334 0.867683
H 2.854778 3.051072 -2.234819
H 2.171032 1.471353 -2.687262
H 1.713491 2.226807 -1.123941
H 5.784666 0.696289 -1.679293
H 5.203594 2.093117 -2.632305
H 4.572491 0.460827 -2.973626
H 4.567679 -1.763018 2.237485
H 3.077416 -0.763138 2.254807
H 3.210831 -2.171716 1.161171
H 5.812049 1.324050 0.629213
H 5.838414 0.244608 2.043566
H 4.478627 1.387266 1.829379
H -4.622770 -2.555757 0.826346
H -3.905204 2.414950 0.140969
H -6.600212 -0.970857 0.722791
H -6.247147 1.473128 0.386173


