%chk=000291493.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291493

0 1
O -2.221835 0.525070 0.142140
O 2.573689 1.592967 0.437273
N -2.937524 -1.571940 -0.513509
N 2.578657 -0.630991 -0.191763
C -1.094176 -0.249081 -0.094147
C -1.520943 -1.553673 -0.502024
C 1.174334 -0.869622 -0.277358
C 0.236037 0.127686 0.028745
C -3.325298 -0.366273 -0.139842
C -0.563025 -2.528697 -0.802111
C 0.776292 -2.177726 -0.687078
C -4.645125 0.222874 0.038151
C 3.199872 0.590342 0.171327
C -4.777213 1.559153 0.455006
C -5.788598 -0.556865 -0.210681
C 4.696388 0.497185 0.173161
C -6.049336 2.108869 0.620931
C -7.056314 0.003996 -0.041255
C 5.423410 1.283427 -0.729705
C 5.356162 -0.328062 1.092796
C -7.187917 1.333461 0.373486
C 6.820278 1.229887 -0.719956
C 6.752937 -0.372518 1.099687
C 7.483759 0.402848 0.192477
H 0.525289 1.135494 0.342052
H -0.870087 -3.526482 -1.114785
H 1.536586 -2.921701 -0.917113
H 3.181759 -1.422325 -0.435539
H -3.883794 2.158066 0.646171
H -5.679047 -1.594901 -0.534480
H -6.154430 3.143909 0.943810
H -7.943912 -0.597652 -0.233282
H 4.901239 1.938789 -1.428820
H 4.786236 -0.921885 1.807602
H -8.179044 1.766638 0.504287
H 7.391298 1.838373 -1.420648
H 7.272549 -1.008635 1.815367
H 8.573148 0.365598 0.200027


%chk=000291493-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291493

0 1
O -2.243145 0.628756 0.063401
O 2.686521 1.702482 0.057058
N -2.974676 -1.558075 -0.223549
N 2.580645 -0.634259 -0.137216
C -1.105093 -0.195004 -0.056236
C -1.560369 -1.533756 -0.232093
C 1.176984 -0.856758 -0.163337
C 0.233662 0.197844 -0.016696
C -3.349769 -0.292971 -0.050112
C -0.611110 -2.567078 -0.379972
C 0.749417 -2.213633 -0.342673
C -4.693915 0.266361 0.038257
C 3.268996 0.575007 -0.001214
C -4.897727 1.659882 0.233510
C -5.814949 -0.602707 -0.072560
C 4.770600 0.455882 0.050679
C -6.208109 2.173228 0.316673
C -7.120022 -0.080514 0.011486
C 5.524604 1.603333 -0.306175
C 5.452447 -0.718569 0.469031
C -7.322215 1.307818 0.206395
C 6.933569 1.570258 -0.275188
C 6.863589 -0.748777 0.504587
C 7.607897 0.392242 0.125191
H 0.561907 1.229483 0.108630
H -0.927293 -3.604260 -0.517845
H 1.508040 -2.998468 -0.454082
H 3.154817 -1.468074 -0.277146
H -4.031682 2.323189 0.317982
H -5.639559 -1.672790 -0.222583
H -6.361797 3.247219 0.467321
H -7.980825 -0.752430 -0.074367
H 4.981485 2.508221 -0.597170
H 4.898862 -1.600200 0.816367
H -8.339010 1.710631 0.271468
H 7.506009 2.459799 -0.559274
H 7.380757 -1.654611 0.839015
H 8.702757 0.366903 0.152839


