%chk=000180731.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180731

0 1
O -3.372630 -1.119617 -0.005391
N -1.807497 0.664545 -0.000068
N -1.037048 -1.482562 -0.003506
N 2.293108 0.299120 0.003989
N 0.420008 1.838578 0.004579
N 1.933449 -2.136180 -0.001882
C 0.075212 -0.607804 -0.000584
C -0.406680 0.713711 0.001481
C 1.489789 -0.926459 0.000348
C -2.229636 -0.718931 -0.003375
C -2.713921 1.819344 0.000837
C 1.719350 1.584148 0.005640
C 3.768869 0.177676 0.005756
H -0.963360 -2.489237 -0.005606
H -3.763674 1.466311 -0.000717
H -2.546052 2.446356 -0.893708
H -2.547750 2.443542 0.897667
H 2.412431 2.442738 0.007998
H 4.258664 1.165788 0.008418
H 4.118708 -0.361221 -0.894046
H 4.116144 -0.364848 0.904393
H 2.920816 -2.348200 -0.001224


%chk=000180731-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180731

0 1
O -3.404823 -1.107787 -0.005707
N -1.780331 0.673180 -0.000193
N -1.015310 -1.441820 -0.003529
N 2.287250 0.310402 0.003956
N 0.412157 1.850637 0.004798
N 1.926216 -2.160399 -0.001465
C 0.089913 -0.593559 -0.000475
C -0.383970 0.720850 0.001613
C 1.491910 -0.915578 0.000530
C -2.216895 -0.692439 -0.003260
C -2.703370 1.806204 0.000780
C 1.715985 1.585419 0.005835
C 3.753039 0.159339 0.005417
H -0.971587 -2.459496 -0.005630
H -3.726379 1.395986 -0.000935
H -2.554298 2.432790 -0.895051
H -2.556065 2.429748 0.899019
H 2.421188 2.422300 0.008358
H 4.223462 1.154664 0.008082
H 4.089290 -0.387904 -0.894115
H 4.087105 -0.391679 0.903462
H 2.953813 -2.284061 -0.000493


