%chk=000291822.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291822

0 1
O -0.458336 -1.870980 -0.622218
N 0.005738 0.267278 0.147204
N -0.451914 1.483476 0.592254
N -1.660578 1.764206 0.684338
C 1.460636 0.126144 0.089271
C 3.635378 1.084632 -0.348052
C 3.438527 -1.231467 0.370880
C 2.041958 -1.101145 0.429292
C 2.239611 1.223512 -0.302233
C -2.323874 -0.442027 -0.141343
C 4.230471 -0.140148 -0.013346
C -0.894539 -0.806292 -0.250083
C -2.693443 0.839637 0.327129
C 4.473399 2.251023 -0.759662
C 4.065277 -2.540374 0.725065
C -3.326268 -1.362474 -0.499821
C -4.047454 1.203336 0.440556
C -4.664203 -1.000186 -0.387562
C -5.021953 0.278101 0.081432
H 1.424660 -1.954340 0.711602
H 1.776357 2.175148 -0.557607
H 5.311786 -0.244607 -0.053575
H 4.233728 2.570324 -1.784665
H 4.300719 3.116804 -0.103098
H 5.549127 2.035219 -0.732062
H 3.859982 -2.808581 1.771909
H 3.666130 -3.353796 0.100178
H 5.155231 -2.541302 0.598191
H -3.035076 -2.352761 -0.862870
H -4.309794 2.198025 0.805625
H -5.445882 -1.708469 -0.663736
H -6.078099 0.542683 0.162706


%chk=000291822-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291822

0 1
O -0.518731 -1.997637 -0.594954
N -0.006329 0.202031 0.133139
N -0.413306 1.529929 0.547650
N -1.680638 1.824855 0.610335
C 1.435847 0.064768 0.074079
C 3.617398 1.104487 -0.331416
C 3.469386 -1.266739 0.360531
C 2.058645 -1.161267 0.403672
C 2.207172 1.192853 -0.291870
C -2.328832 -0.457672 -0.126201
C 4.232331 -0.130697 -0.005604
C -0.909960 -0.853476 -0.224610
C -2.671269 0.863591 0.285586
C 4.448907 2.313915 -0.724320
C 4.142437 -2.583682 0.707997
C -3.356477 -1.380176 -0.446816
C -4.032260 1.258695 0.381620
C -4.702643 -0.985047 -0.352743
C -5.040866 0.334984 0.062730
H 1.454297 -2.030122 0.671420
H 1.703433 2.133451 -0.531622
H 5.326147 -0.209270 -0.041128
H 4.204029 2.653799 -1.748098
H 4.261967 3.166881 -0.045668
H 5.528518 2.088179 -0.693899
H 3.925430 -2.882468 1.750824
H 3.782547 -3.400400 0.055212
H 5.238424 -2.519115 0.597621
H -3.070689 -2.388015 -0.763205
H -4.256322 2.280327 0.702630
H -5.498124 -1.695968 -0.599539
H -6.093167 0.629603 0.132345


