%chk=000202168.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202168

0 1
O 1.619061 -3.388941 0.191978
O 1.907004 -0.686173 0.297274
O -5.811992 0.569039 -0.631474
N -1.654459 -1.806711 -0.308714
C -0.497580 -2.254430 0.518559
C 0.669773 -2.538821 -0.454895
C -2.526004 -0.828773 0.413426
C -3.765577 -0.535253 -0.441359
C 1.350065 -1.244684 -0.932235
C -4.609138 0.578544 0.178688
C 2.620207 0.489470 0.212456
C 2.829051 1.227303 -0.958203
C 3.135440 0.901736 1.459271
C -6.750068 1.598470 -0.275817
C 3.576299 2.408048 -0.870018
C 3.873390 2.079679 1.512911
C 4.096935 2.836178 0.352251
H -0.700401 -3.167280 1.117641
H -0.188450 -1.466984 1.241586
H 0.339964 -3.149584 -1.328609
H -1.932994 0.103022 0.559749
H -2.830893 -1.179336 1.423430
H -2.207190 -2.623088 -0.594082
H -3.467601 -0.249741 -1.472444
H -4.393629 -1.441065 -0.565909
H 2.175871 -1.444713 -1.634268
H 0.619174 -0.532844 -1.356363
H -4.883721 0.372505 1.227208
H -4.124826 1.566718 0.105048
H 2.133916 -2.881895 0.862494
H 2.429111 0.908825 -1.914028
H 2.950430 0.300198 2.344293
H -7.571318 1.427677 -0.983490
H -6.312965 2.589810 -0.426186
H -7.095776 1.469166 0.753673
H 3.750439 2.996586 -1.771066
H 4.282268 2.417626 2.465289
H 4.675986 3.754018 0.408033


%chk=000202168-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202168

0 1
O 1.636956 -3.422015 0.456145
O 2.010055 -0.694900 0.396434
O -5.759238 0.905171 -0.830680
N -1.592063 -1.617454 -0.294123
C -0.550722 -2.245792 0.548425
C 0.702502 -2.576335 -0.297954
C -2.680689 -0.940377 0.447277
C -3.699041 -0.320976 -0.530000
C 1.405497 -1.310334 -0.805341
C -4.842812 0.395344 0.194485
C 2.743752 0.493689 0.240831
C 2.916282 1.162533 -0.995985
C 3.322688 1.013378 1.425237
C -6.884410 1.634865 -0.252556
C 3.674858 2.355956 -1.034073
C 4.075248 2.203049 1.369430
C 4.257100 2.882753 0.139486
H -0.878186 -3.184394 1.052242
H -0.267413 -1.526917 1.340650
H 0.405550 -3.187632 -1.171191
H -2.222984 -0.142882 1.066074
H -3.213195 -1.628432 1.152605
H -1.976903 -2.286141 -0.977737
H -3.182190 0.393193 -1.195781
H -4.136037 -1.110200 -1.174026
H 2.205617 -1.564896 -1.527212
H 0.661543 -0.628171 -1.258545
H -5.382705 -0.304828 0.873570
H -4.452681 1.238004 0.811194
H 2.138356 -2.818716 1.065935
H 2.471231 0.773042 -1.915983
H 3.172424 0.476410 2.367263
H -7.503699 1.972419 -1.098541
H -6.542882 2.518795 0.328676
H -7.494280 0.986753 0.413825
H 3.807688 2.872852 -1.991261
H 4.521455 2.600718 2.287807
H 4.843129 3.806771 0.099497


