%chk=000242992.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242992

0 1
O 4.413766 0.605749 1.726541
O 1.777500 -0.874982 -0.195817
O 5.731081 -1.059698 0.429221
O 3.573711 0.185111 -2.225265
O -0.402438 2.337571 2.155060
O 1.519839 2.171754 0.392380
O -0.517891 -1.088298 1.208656
N -2.133089 0.389749 1.867239
N -3.235630 -0.435476 1.558771
C 3.734138 0.284066 0.518866
C 2.278019 -0.098655 0.890382
C 4.461868 -0.880774 -0.203401
C 1.389037 1.149065 1.012661
C 4.635506 -0.616749 -1.711668
C 0.230532 1.070746 2.031117
C -0.821017 0.025033 1.629239
C -3.693575 -0.381933 0.179247
C -4.344985 -1.520810 -0.333268
C -3.616425 0.796149 -0.581179
C -4.929192 -1.463563 -1.598954
C -4.200170 0.830177 -1.850566
C -4.857048 -0.292515 -2.361825
H 3.759329 1.234872 -0.075693
H 2.254667 -0.698238 1.829669
H 3.959804 -1.861041 -0.018211
H 4.689793 -1.563478 -2.279527
H 5.538966 -0.014176 -1.927416
H 0.612224 0.837998 3.059077
H 4.851454 -0.200813 2.113387
H 0.922353 -1.339969 0.078421
H 6.288905 -0.250270 0.332470
H 2.695009 -0.220802 -2.000629
H -2.390771 1.332831 2.195629
H -0.126891 2.938956 1.397217
H -3.027702 -1.414515 1.850164
H -4.402331 -2.438282 0.248954
H -3.116215 1.680979 -0.196231
H -5.440176 -2.340559 -1.996783
H -4.141233 1.742790 -2.444262
H -5.309720 -0.257400 -3.350675


%chk=000242992-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242992

0 1
O 4.173456 1.197979 1.781616
O 2.092200 -0.854414 -0.468979
O 6.352531 0.241831 0.582299
O 4.203303 -2.241958 -1.278049
O -0.486235 1.926584 2.064683
O 1.599009 2.168538 0.435574
O -0.253389 -1.416634 0.572345
N -1.988179 -0.020387 1.223373
N -2.986195 -0.898530 0.786523
C 3.940294 0.485370 0.516448
C 2.537735 -0.107139 0.717196
C 5.101835 -0.526431 0.303290
C 1.507936 1.018805 0.931907
C 5.186058 -1.193616 -1.088440
C 0.258903 0.709552 1.799016
C -0.668632 -0.329518 1.120817
C -3.964653 -0.448862 -0.144361
C -4.914649 -1.393711 -0.618656
C -4.048527 0.905346 -0.559495
C -5.930205 -0.983045 -1.503722
C -5.081013 1.302850 -1.438079
C -6.025925 0.368306 -1.916540
H 3.919022 1.201005 -0.334647
H 2.556294 -0.766874 1.609375
H 5.080651 -1.302214 1.087859
H 6.171342 -1.684437 -1.172391
H 5.114718 -0.404856 -1.877715
H 0.614091 0.279291 2.757954
H 5.161829 1.320665 1.839109
H 1.194832 -1.277568 -0.223329
H 6.620731 0.724413 -0.242908
H 3.290929 -1.837955 -1.115282
H -2.254313 0.833887 1.727932
H -0.054968 2.649493 1.519949
H -2.634876 -1.858075 0.699596
H -4.858465 -2.437938 -0.288526
H -3.306089 1.638395 -0.227538
H -6.653543 -1.720785 -1.868175
H -5.136573 2.349808 -1.756521
H -6.820267 0.683431 -2.600509


