%chk=000232658.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232658

0 1
O -4.937444 -0.639810 -0.011698
O 3.620907 -1.097035 -0.513832
O 4.191368 0.952046 0.323717
N -0.395304 0.902336 -0.293986
N 2.381055 0.727204 -1.147088
C 0.632402 1.832369 0.282842
C 0.221775 -0.430388 -0.600516
C 1.775385 2.027022 -0.734014
C 1.356918 -0.242729 -1.626872
C -1.557918 0.759848 0.644374
C -2.753742 0.175327 -0.120878
C -4.020066 0.194235 0.735272
C 3.442553 0.265312 -0.343246
C -6.267245 -0.702613 0.564205
C 4.823434 -1.680147 0.084256
C -7.029541 -1.618419 -0.377779
C 4.634966 -1.841958 1.578000
H 0.144258 2.813961 0.469213
H 1.043844 1.483493 1.254433
H 0.605967 -0.953264 0.301638
H -0.565203 -1.082060 -1.041234
H 2.564806 2.688833 -0.309776
H 1.390146 2.512935 -1.660380
H 0.948231 0.162158 -2.582264
H 1.840358 -1.218659 -1.856657
H -1.325623 0.136419 1.534420
H -1.824355 1.771874 1.023390
H -2.921382 0.739841 -1.062049
H -2.551871 -0.865415 -0.448640
H -3.866327 -0.251480 1.733193
H -4.443644 1.207431 0.839373
H -6.196967 -1.113567 1.586206
H -6.692657 0.315564 0.596947
H 5.687974 -1.040370 -0.168000
H 4.870067 -2.641713 -0.459062
H -7.023959 -1.219744 -1.401700
H -8.069907 -1.745314 -0.063298
H -6.559716 -2.609948 -0.428690
H 3.704503 -2.371902 1.814418
H 4.586973 -0.859808 2.075190
H 5.464278 -2.398366 2.029473


%chk=000232658-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232658

0 1
O -5.259369 -0.616654 -0.202789
O 4.010260 -1.096102 -0.565065
O 4.453165 1.110012 0.135015
N -0.511416 0.762059 -0.141797
N 2.311444 0.460368 -0.573890
C 0.455565 1.718093 0.459309
C 0.095305 -0.590328 -0.242746
C 1.733597 1.805852 -0.394313
C 1.375477 -0.551395 -1.100795
C -1.805995 0.768508 0.584856
C -2.920093 -0.005570 -0.149652
C -4.291284 0.238266 0.490481
C 3.643844 0.241900 -0.298120
C -6.624734 -0.459865 0.318496
C 5.425257 -1.435602 -0.248253
C -7.533080 -1.395037 -0.479372
C 5.590302 -1.796706 1.231037
H -0.017384 2.716808 0.504179
H 0.735057 1.421696 1.503111
H 0.343996 -1.000334 0.770823
H -0.624677 -1.276971 -0.720285
H 2.491164 2.445556 0.085821
H 1.479544 2.230805 -1.386301
H 1.099800 -0.284568 -2.141355
H 1.871760 -1.532132 -1.103955
H -1.694067 0.362704 1.625671
H -2.114228 1.828462 0.686947
H -2.946296 0.312197 -1.207729
H -2.731021 -1.094748 -0.134623
H -4.270977 -0.011972 1.577298
H -4.587090 1.308551 0.393043
H -6.645268 -0.712885 1.403010
H -6.949851 0.599811 0.210300
H 6.063271 -0.576594 -0.520563
H 5.638805 -2.292007 -0.908882
H -7.505139 -1.135624 -1.551727
H -8.577190 -1.317827 -0.124925
H -7.200212 -2.441500 -0.369000
H 4.909110 -2.617773 1.515494
H 5.383226 -0.919671 1.866849
H 6.628717 -2.126281 1.423297


