%chk=000267143.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267143

0 1
O 1.295134 1.227831 0.665614
O -2.407417 2.038055 1.406731
O -2.832586 -1.821512 2.083472
O 2.335283 3.234200 0.789555
O 1.599472 -2.349065 1.522672
O 0.728850 -3.565895 3.183512
N -0.945832 2.226123 -0.340990
N -0.830472 -0.928930 1.463605
C -2.717774 0.577592 -0.498702
C -2.752556 -0.753263 -0.061301
C -2.045744 1.645165 0.316377
C -3.341750 0.937295 -1.700819
C -3.406548 -1.722948 -0.835606
C -0.070484 3.157936 0.382579
C -2.186832 -1.208291 1.254319
C 3.059204 0.252875 -0.642506
C 2.582795 0.528708 0.752950
C -3.988699 -0.033622 -2.470439
C -4.016980 -1.363925 -2.040228
C 1.319922 2.602207 0.631959
C 2.738361 -0.962697 -1.263391
C 3.817687 1.212979 -1.328208
C -0.199836 -1.327998 2.727127
C 3.185884 -1.220291 -2.561954
C 4.261777 0.950515 -2.626536
C 3.948454 -0.265719 -3.243170
C 0.693039 -2.543725 2.550614
H -3.332332 1.977703 -2.030237
H -3.451228 -2.756648 -0.481603
H 0.027482 4.111605 -0.195952
H -0.536593 3.439306 1.369746
H -0.553056 1.808652 -1.182166
H 3.292122 1.138764 1.343742
H 2.302108 -0.387195 1.314617
H -4.476521 0.249176 -3.403882
H -4.524953 -2.121561 -2.638259
H -0.242531 -0.422674 0.800580
H 2.138331 -1.702940 -0.731460
H 4.054329 2.164507 -0.846098
H 0.398391 -0.485462 3.151456
H -0.992555 -1.586102 3.489283
H 2.940456 -2.165323 -3.043905
H 4.854036 1.694248 -3.158099
H 4.298726 -0.469244 -4.254026
H 2.194233 -3.136912 1.389228


%chk=000267143-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267143

0 1
O 1.302821 1.299814 0.693601
O -2.340218 1.883632 1.530689
O -2.481294 -2.430104 1.716406
O 2.304747 3.410409 0.597814
O 1.268682 -2.675193 1.398491
O 0.987897 -3.254573 3.628627
N -1.016298 2.276741 -0.345450
N -0.817241 -0.836710 1.519035
C -2.701140 0.529379 -0.490749
C -2.707517 -0.842270 -0.100771
C -2.030941 1.604622 0.334831
C -3.403668 0.929779 -1.656422
C -3.445299 -1.771424 -0.877582
C -0.138982 3.220041 0.339906
C -2.003907 -1.417404 1.109929
C 3.151508 0.305123 -0.641492
C 2.676631 0.644257 0.751449
C -4.120720 -0.009627 -2.427855
C -4.145251 -1.366304 -2.032057
C 1.285146 2.690578 0.549891
C 2.703899 -0.885366 -1.272450
C 4.035273 1.172848 -1.333113
C -0.203354 -1.273638 2.764803
C 3.132713 -1.200274 -2.580493
C 4.466314 0.854100 -2.640346
C 4.015612 -0.331989 -3.265999
C 0.705997 -2.502102 2.676064
H -3.418629 1.989429 -1.935973
H -3.462117 -2.812770 -0.540943
H -0.055296 4.180420 -0.196769
H -0.597617 3.417210 1.329085
H -0.766141 1.959069 -1.284013
H 3.353462 1.340359 1.273351
H 2.485481 -0.255880 1.354058
H -4.668020 0.318280 -3.318080
H -4.708866 -2.101155 -2.616463
H -0.357874 -0.084939 0.996568
H 2.022041 -1.553880 -0.733147
H 4.371786 2.096125 -0.847642
H 0.395965 -0.444334 3.184964
H -0.987165 -1.530321 3.496858
H 2.785335 -2.120317 -3.063654
H 5.151727 1.526009 -3.168464
H 4.351906 -0.579475 -4.279165
H 1.835409 -3.494676 1.412874


