%chk=000220610.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220610

0 1
O -7.244762 0.674022 -0.181707
O -0.631089 -1.717276 -0.150600
O 3.995378 -3.031695 -0.252811
N -4.476297 0.051724 0.152038
N 0.413622 0.329662 0.065852
N 2.395608 2.268864 0.272908
C -4.984452 0.658239 -1.122666
C -5.540308 -0.810522 0.764867
C -3.219776 -0.728542 -0.081598
C -6.234176 1.494100 -0.802679
C -6.777806 0.060146 1.036890
C -2.031461 0.244313 0.036284
C -0.722686 -0.511265 -0.028752
C 1.770250 -0.087821 0.032172
C 2.791462 0.942741 0.141843
C 4.164483 0.562295 0.111673
C 2.144832 -1.412024 -0.099519
C 3.523413 -1.749578 -0.125765
C 4.528654 -0.796674 -0.023646
C 5.142880 1.610800 0.223640
C 4.737673 2.910840 0.352487
C 3.330674 3.203998 0.373174
C 3.033360 -4.111357 -0.366053
H -5.230186 -0.102255 -1.895549
H -4.191413 1.311182 -1.543277
H -5.152420 -1.219470 1.722398
H -5.821509 -1.673442 0.123473
H -3.189190 -1.250199 -1.062703
H -3.111716 -1.525807 0.688899
H -5.999995 2.342523 -0.135766
H -6.744337 1.849729 -1.714701
H -7.649970 -0.539973 1.349640
H -6.566756 0.850194 1.779131
H -2.118662 0.808762 0.992544
H -2.085575 1.014886 -0.759876
H 0.271386 1.346838 0.175142
H 1.382735 -2.193954 -0.182351
H 5.572655 -1.094776 -0.047573
H 6.198720 1.340640 0.203001
H 5.449331 3.728886 0.439786
H 2.993604 4.241820 0.475905
H 2.416441 -4.166538 0.536058
H 3.691056 -4.985849 -0.450732
H 2.425224 -3.985285 -1.266984


%chk=000220610-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220610

0 1
O -7.209408 0.947559 -0.312850
O -0.662402 -1.903874 0.423614
O 4.158982 -3.115193 0.060528
N -4.508030 -0.024239 0.177658
N 0.419179 0.158849 0.181569
N 2.184405 2.136770 -0.096020
C -4.753014 1.275859 -0.500258
C -5.632602 -0.958516 -0.098371
C -3.196448 -0.622632 -0.168456
C -6.094941 1.868732 -0.039336
C -6.959808 -0.336393 0.364660
C -2.020423 0.147129 0.467447
C -0.708389 -0.635746 0.350236
C 1.767976 -0.236478 0.090151
C 2.703988 0.854182 -0.060038
C 4.115175 0.564502 -0.163463
C 2.224584 -1.561125 0.132325
C 3.628776 -1.820721 0.026653
C 4.564864 -0.785045 -0.118257
C 4.990866 1.693943 -0.309712
C 4.459363 2.984952 -0.344756
C 3.043001 3.164863 -0.234278
C 3.227772 -4.242147 0.202858
H -4.767324 1.154988 -1.613930
H -3.944304 1.985198 -0.245197
H -5.455297 -1.902034 0.451638
H -5.706631 -1.202896 -1.188439
H -3.046428 -0.690706 -1.276170
H -3.166805 -1.654771 0.223445
H -6.047941 2.086544 1.049783
H -6.333012 2.792164 -0.592968
H -7.815337 -0.980379 0.102057
H -6.931778 -0.179251 1.464603
H -2.252878 0.283314 1.542425
H -1.905505 1.155597 0.028285
H 0.325616 1.186033 0.122798
H 1.490009 -2.359755 0.245311
H 5.628477 -1.029628 -0.195418
H 6.071016 1.528252 -0.392192
H 5.105608 3.861164 -0.455003
H 2.606625 4.169660 -0.259838
H 2.667498 -4.183395 1.154904
H 3.866814 -5.137082 0.200226
H 2.517014 -4.285341 -0.643728


