%chk=000267295.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267295

0 1
O 2.330099 1.231376 0.556312
O 4.321218 -1.377094 -0.151667
O 5.572802 1.254385 2.194710
O -0.464645 1.450179 -1.737392
O -2.186237 -2.674503 -0.634633
N 0.983770 -0.113081 -0.858836
N -1.359301 -0.621664 -1.195927
C 2.073969 0.907210 -0.820904
C 4.291752 0.057863 -0.221002
C 3.391711 0.390562 -1.418161
C 3.559872 0.619587 1.025762
C 4.305024 1.750792 1.751957
C -0.317307 0.329077 -1.281322
C 1.178221 -1.407394 -0.338941
C 0.162781 -2.302521 -0.256615
C -1.206281 -1.959609 -0.670015
C -2.732608 -0.154398 -1.572072
C 0.368306 -3.681188 0.273304
C -3.421992 0.466196 -0.382366
C -3.301679 1.842031 -0.141331
C -4.177524 -0.335705 0.484697
C -3.956384 2.415914 0.951634
C -4.830048 0.243724 1.575943
C -4.724010 1.619247 1.807854
H 1.688075 1.862690 -1.265235
H 5.328334 0.429754 -0.331053
H 3.849221 1.151341 -2.075377
H 3.252239 -0.508019 -2.058183
H 3.265794 -0.192110 1.726326
H 3.778732 2.026857 2.689063
H 4.415145 2.649989 1.125111
H 2.207678 -1.655350 -0.023772
H 4.964765 -1.679256 0.524947
H -3.302844 -1.037600 -1.951925
H -2.647250 0.572352 -2.414701
H 6.272159 1.461467 1.544378
H 0.454505 -3.677201 1.369731
H 1.270516 -4.152609 -0.137374
H -0.483707 -4.338225 0.025688
H -2.685852 2.457039 -0.800686
H -4.241304 -1.412157 0.310109
H -3.865422 3.484405 1.137599
H -5.419177 -0.378110 2.247452
H -5.235119 2.068760 2.656712


%chk=000267295-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267295

0 1
O 2.381241 1.563863 0.094695
O 4.501121 -1.320117 -0.055838
O 5.202593 0.754341 2.316535
O -0.523122 1.474767 -1.834651
O -2.136772 -2.710771 -0.452972
N 1.014758 -0.126367 -1.052734
N -1.322257 -0.618304 -1.135898
C 2.101400 0.877510 -1.187077
C 4.285293 0.111281 -0.312443
C 3.463858 0.282587 -1.616819
C 3.401349 0.760258 0.795703
C 4.179331 1.658734 1.749845
C -0.299377 0.320887 -1.366850
C 1.253884 -1.415228 -0.560320
C 0.250644 -2.328025 -0.344888
C -1.138290 -1.946334 -0.624515
C -2.722851 -0.180588 -1.440305
C 0.505839 -3.721433 0.175697
C -3.410243 0.483607 -0.251350
C -3.322692 1.886851 -0.063254
C -4.155228 -0.295543 0.670709
C -3.971319 2.501565 1.031331
C -4.803741 0.320324 1.764601
C -4.714728 1.720450 1.946934
H 1.703002 1.657202 -1.850153
H 5.262373 0.625268 -0.380796
H 3.955728 1.003611 -2.288655
H 3.376424 -0.674960 -2.153816
H 2.916176 -0.051630 1.376546
H 3.513700 2.062502 2.537056
H 4.645549 2.499043 1.196361
H 2.301755 -1.669069 -0.365355
H 5.010102 -1.393195 0.792957
H -3.263032 -1.092862 -1.740032
H -2.652742 0.517262 -2.289637
H 5.704740 1.213014 3.033084
H -0.026333 -3.886374 1.130214
H 1.583460 -3.898744 0.332715
H 0.118749 -4.479324 -0.529182
H -2.734918 2.483790 -0.769727
H -4.207900 -1.380976 0.528844
H -3.899602 3.586601 1.168456
H -5.378996 -0.288892 2.471116
H -5.220929 2.198420 2.793665


