%chk=000220678.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220678

0 1
O 3.110787 1.259573 0.213754
O 0.614474 1.174453 2.188098
O 3.212336 -0.319086 1.851032
N 1.316946 -1.045080 -2.025335
C -1.181974 0.193309 0.089506
C -1.955365 -0.674020 0.886814
C -3.189975 1.318230 -0.694232
C -1.796212 1.178091 -0.696523
C -3.351877 -0.523829 0.882094
C -3.963138 0.458212 0.104477
C 0.295099 0.081875 0.063100
C -1.312929 -1.736960 1.714051
C -3.850970 2.355653 -1.540503
C 1.070143 0.549378 1.070918
C 2.576759 0.413385 1.139679
C 4.563454 1.200636 -0.014695
C 0.863443 -0.541456 -1.087784
C 4.888653 -0.014662 -0.851906
H -1.181013 1.830192 -1.317017
H -3.966490 -1.187834 1.489689
H -5.048110 0.555240 0.111855
H -0.719020 -2.421769 1.087370
H -0.625904 -1.318302 2.463995
H -2.041366 -2.354737 2.255321
H -3.165249 3.161138 -1.835732
H -4.240034 1.909730 -2.469069
H -4.699546 2.829167 -1.028229
H 4.715498 2.158306 -0.547014
H 5.072634 1.204812 0.964641
H 5.912927 0.026270 -1.242130
H 4.794073 -0.946112 -0.274280
H 4.211205 -0.106693 -1.715231
H -0.386562 1.284591 2.168486


%chk=000220678-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220678

0 1
O 3.115894 0.457293 -0.309226
O 0.529644 1.011881 2.107692
O 3.220020 1.398177 1.829563
N 1.022733 0.256182 -2.744546
C -1.230064 0.428220 -0.058939
C -1.813560 -0.639078 0.695258
C -3.462587 1.400516 -0.512962
C -2.055882 1.416528 -0.656992
C -3.225361 -0.641788 0.840498
C -4.034357 0.355931 0.258958
C 0.263984 0.520438 -0.245250
C -0.981165 -1.765745 1.285715
C -4.333349 2.448035 -1.182671
C 1.069282 0.792127 0.848799
C 2.565689 0.925766 0.873559
C 4.603219 0.564478 -0.453047
C 0.743178 0.382011 -1.585715
C 5.291064 -0.656933 0.161235
H -1.582739 2.209956 -1.247671
H -3.694274 -1.451317 1.412302
H -5.122121 0.317916 0.394230
H -0.266146 -2.166418 0.544979
H -0.385327 -1.439332 2.159515
H -1.629263 -2.594050 1.617511
H -3.759813 3.358552 -1.426796
H -4.757414 2.061846 -2.129619
H -5.182741 2.740498 -0.539906
H 4.745452 0.620708 -1.543453
H 4.932798 1.501640 0.029196
H 6.378292 -0.604078 -0.033210
H 5.137705 -0.688423 1.252763
H 4.906192 -1.589642 -0.285194
H -0.466286 1.019805 2.048623


