%chk=000229843.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229843

0 1
O 4.032206 0.117093 -0.002419
O -4.646464 -1.178598 -0.084309
O -4.276961 0.949570 0.051992
N -3.902631 -0.212892 -0.022502
C -0.118355 0.339473 0.012301
C 2.664567 0.084605 -0.004239
C 0.708715 1.488492 0.085062
C 0.484936 -0.929054 -0.068220
C 2.087893 1.374478 0.077674
C 1.872202 -1.070329 -0.077401
C -1.563202 0.515678 0.023695
C -2.464787 -0.483653 -0.039944
C 4.749139 -1.141726 -0.082066
H 0.251359 2.478937 0.147894
H -0.139327 -1.824227 -0.124884
H 2.738037 2.246466 0.132934
H 2.315760 -2.059093 -0.140258
H -1.922043 1.558717 0.090288
H -2.219626 -1.546371 -0.107773
H 4.521635 -1.649245 -1.023811
H 4.521312 -1.764141 0.787939
H 5.794037 -0.802381 -0.060354


%chk=000229843-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229843

0 1
O 4.101566 0.142025 -0.001081
O -4.760931 -1.183597 -0.079032
O -4.319198 1.061627 0.058704
N -3.941048 -0.176932 -0.018136
C -0.133662 0.322012 0.009543
C 2.708761 0.126289 -0.002935
C 0.688744 1.489062 0.084566
C 0.514552 -0.945028 -0.072556
C 2.086068 1.399912 0.078875
C 1.915240 -1.051894 -0.079407
C -1.582306 0.487556 0.020975
C -2.523557 -0.501466 -0.039834
C 4.810395 -1.142297 -0.080035
H 0.212483 2.474322 0.148352
H -0.081762 -1.861910 -0.132393
H 2.718376 2.290249 0.136439
H 2.380255 -2.039718 -0.144034
H -1.972648 1.512969 0.085532
H -2.349897 -1.575916 -0.106347
H 4.573495 -1.671175 -1.022409
H 4.566341 -1.785891 0.786040
H 5.877136 -0.878400 -0.059228


