%chk=000228160.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228160

0 1
O -0.065382 1.684360 1.228862
O 3.184401 -2.057723 -0.449170
O -2.178894 -2.015384 1.058074
N -0.025078 -1.612985 1.347996
N -2.222393 0.746856 1.158673
N 2.228829 0.027314 0.050045
N -2.826224 1.830621 0.459260
N 3.096141 0.756948 -0.819774
N -0.985640 -2.419041 0.777007
C -0.452925 -0.520712 2.257534
C 1.372174 -2.064573 1.151966
C -0.899866 0.760179 1.510336
C 2.336434 -1.341573 0.149444
C -4.274374 1.878363 0.743570
C -2.467955 1.842112 -0.983311
C 3.872842 1.766020 -0.062525
C 2.352139 1.306595 -1.977846
H -1.282486 -0.910652 2.877151
H 0.400684 -0.250199 2.897362
H 1.875889 -2.085636 2.137226
H 1.308995 -3.097064 0.773766
H -2.703716 -0.173089 1.218417
H 1.515158 0.579881 0.568717
H -4.692010 2.776171 0.258667
H -4.832139 0.986512 0.366644
H -4.432467 1.966051 1.830871
H -1.371301 1.898487 -1.075147
H -2.841673 0.949106 -1.534986
H -2.898291 2.751029 -1.436068
H 4.453332 1.257738 0.724454
H 4.580894 2.251840 -0.756308
H 3.236498 2.553649 0.406290
H 3.074778 1.789308 -2.658722
H 1.867563 0.477893 -2.519404
H 1.578563 2.058202 -1.688470


%chk=000228160-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228160

0 1
O -0.095985 1.655802 1.004974
O 3.407035 -1.866516 -0.106168
O -2.148794 -2.122006 1.094632
N 0.012165 -1.576992 1.401297
N -2.259156 0.741275 1.104017
N 2.082909 0.066343 -0.028837
N -2.881738 1.771758 0.342177
N 2.930355 0.786509 -0.931402
N -0.915230 -2.455353 0.864940
C -0.439050 -0.441176 2.240034
C 1.423817 -1.985462 1.262678
C -0.923012 0.768096 1.400980
C 2.377960 -1.238723 0.284307
C -4.324285 1.832996 0.649949
C -2.550131 1.685218 -1.104177
C 4.150890 1.295557 -0.258411
C 2.152905 1.806798 -1.664257
H -1.248190 -0.807328 2.899179
H 0.414777 -0.100620 2.845456
H 1.899509 -1.978598 2.262496
H 1.413212 -3.027891 0.904295
H -2.739317 -0.169001 1.242708
H 1.320717 0.606239 0.433000
H -4.754801 2.696125 0.115807
H -4.885012 0.916885 0.341917
H -4.462637 1.990746 1.732064
H -1.455963 1.745046 -1.218960
H -2.924735 0.752376 -1.584585
H -2.997849 2.556610 -1.610638
H 4.689366 0.440574 0.181224
H 4.801001 1.754645 -1.022998
H 3.935607 2.050652 0.533782
H 2.825421 2.289691 -2.393399
H 1.338155 1.312154 -2.219714
H 1.712586 2.594173 -1.007767


