%chk=000251890.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251890

0 1
O -3.448265 1.589046 0.264264
O 0.565673 3.852057 0.032089
O 5.251828 -0.644153 -0.401523
N -1.086784 -2.898223 0.369835
N 0.265847 1.626653 0.510014
C 0.251731 -0.823020 0.463497
C -0.669715 0.445828 0.394518
C -0.187503 -2.010679 -0.452074
C -1.457707 0.648330 -0.917179
C -2.078240 -0.675261 -1.395411
C -0.878421 -1.581255 -1.751222
C 0.200526 -1.438606 1.886575
C 1.630731 -0.255395 0.200896
C -0.793388 -2.609567 1.815230
C -2.414535 1.840182 -0.714738
C -2.951507 -1.343918 -0.354679
C -2.535073 -2.746799 0.030850
C 1.606979 1.161105 0.276442
C -1.692462 3.044142 -0.077641
C -0.196540 2.908699 0.126276
C 2.825267 -0.926842 -0.021181
C -4.026817 -0.763455 0.190418
C -4.466579 0.636542 -0.106600
C 2.767000 1.927492 0.139720
C 3.986032 -0.146028 -0.167379
C 3.970813 1.260849 -0.085754
C 5.409096 -2.079444 -0.489437
H -1.383623 0.462218 1.257812
H 0.713421 -2.632956 -0.689917
H -0.739481 0.964546 -1.725827
H -2.696389 -0.489831 -2.307462
H -1.207963 -2.469423 -2.322816
H -0.162913 -1.054116 -2.409482
H -0.089381 -0.693146 2.645932
H 1.203272 -1.792751 2.189194
H -0.350501 -3.537665 2.236188
H -1.707729 -2.394634 2.400954
H -2.903540 2.116755 -1.673377
H -3.149121 -3.141598 0.868956
H -2.729895 -3.435048 -0.827872
H -2.165959 3.243586 0.918871
H -1.883572 3.967174 -0.663495
H 2.852590 -2.009300 -0.072298
H -4.638249 -1.283472 0.927443
H -4.754572 0.771420 -1.164694
H -5.304443 0.957065 0.545338
H 2.720381 3.019264 0.202702
H 4.903516 1.810916 -0.200284
H 4.836470 -2.474933 -1.332867
H 5.127390 -2.552890 0.455258
H 6.488303 -2.174862 -0.668963


%chk=000251890-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251890

0 1
O -3.587721 1.508431 0.331341
O 0.553454 3.933039 0.051602
O 5.357049 -0.670452 -0.496690
N -1.130006 -2.776775 0.494539
N 0.315227 1.636206 0.437077
C 0.324416 -0.801679 0.497912
C -0.616603 0.457375 0.427155
C -0.167724 -2.005607 -0.380729
C -1.492841 0.637817 -0.838233
C -2.067260 -0.698639 -1.386214
C -0.837390 -1.588618 -1.706135
C 0.274433 -1.448128 1.920098
C 1.694162 -0.219127 0.178009
C -1.034943 -2.262401 1.896013
C -2.459854 1.823505 -0.568403
C -3.014881 -1.456609 -0.441426
C -2.524571 -2.843241 -0.037807
C 1.655178 1.195130 0.219130
C -1.720277 2.991396 0.157032
C -0.188745 2.913416 0.201438
C 2.906702 -0.896272 -0.053304
C -4.149092 -0.900206 0.063569
C -4.559071 0.530839 -0.216923
C 2.822656 1.969990 0.033923
C 4.082682 -0.125219 -0.251371
C 4.034815 1.292295 -0.205092
C 5.468870 -2.127714 -0.546207
H -1.275658 0.494111 1.315372
H 0.713267 -2.641868 -0.602318
H -0.813558 1.003224 -1.639575
H -2.613921 -0.466951 -2.325746
H -1.127708 -2.489449 -2.276604
H -0.109189 -1.035677 -2.328409
H 0.300863 -0.693702 2.724946
H 1.148285 -2.113504 2.046642
H -1.023027 -3.093862 2.624653
H -1.900946 -1.606692 2.145759
H -2.874623 2.166431 -1.542405
H -3.171751 -3.280689 0.742853
H -2.546183 -3.541538 -0.896596
H -2.100410 2.990498 1.197707
H -1.978286 3.969336 -0.277682
H 2.932856 -1.990298 -0.074028
H -4.778887 -1.483792 0.748542
H -4.679367 0.713587 -1.308716
H -5.511596 0.774042 0.281867
H 2.770945 3.059563 0.066097
H 4.965846 1.845936 -0.359202
H 4.849914 -2.554448 -1.360363
H 5.179009 -2.589038 0.418677
H 6.531459 -2.329373 -0.746677


