%chk=000272039.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272039

0 1
O 0.222630 -1.234566 -1.465467
O 1.962499 1.299754 -0.521765
O 3.280657 -0.588452 -0.649905
O 4.068794 1.199302 0.430577
O 0.962275 -3.196559 1.220985
N -1.251707 -0.203667 0.071476
N -2.823823 1.238116 -1.217078
N -5.107237 1.226070 -0.348286
N -5.753410 0.039543 1.584244
C 1.199519 0.271263 0.134026
C 2.080498 -1.003961 0.045863
C -0.044072 -0.017090 -0.747566
C 1.331120 -1.975269 -0.885392
C 3.322237 0.842074 -0.716271
C 0.743388 -3.218164 -0.194618
C 3.857243 1.322586 -2.035541
C -2.505635 0.356544 -0.208742
C -1.403537 -1.054330 1.209084
C -3.435971 -0.126412 0.775601
C -2.708527 -1.009117 1.647822
C 4.119212 2.622260 0.755331
C -4.767321 0.359601 0.667296
C 4.785505 2.659245 2.116264
C -4.124165 1.622539 -1.221897
H 0.973931 0.631428 1.154985
H 2.396808 -1.426780 1.016874
H -0.227451 0.751463 -1.546729
H 1.947823 -2.242717 -1.775633
H 1.136966 -4.153002 -0.625667
H -0.366735 -3.212036 -0.287456
H 4.955463 1.374619 -2.023946
H 3.566577 0.638352 -2.848512
H 3.460531 2.315578 -2.291663
H -0.564495 -1.616052 1.596509
H -3.122833 -1.527272 2.489542
H 1.837452 -3.579069 1.440371
H 4.713274 3.125811 -0.025839
H 3.085718 3.012709 0.768403
H 4.950301 3.688207 2.453791
H 4.178352 2.142999 2.871973
H 5.756967 2.144933 2.094060
H -4.439143 2.324803 -2.011958
H -5.624896 -0.747569 2.195287
H -6.705983 0.318686 1.395565


%chk=000272039-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272039

0 1
O 0.162885 -1.714571 -1.302955
O 1.694693 1.286462 -0.441526
O 3.071977 -0.402002 -1.260891
O 4.003726 1.122383 0.207422
O 0.969766 -3.064881 1.457665
N -1.343963 -0.438356 0.092353
N -2.621534 1.185512 -1.244557
N -4.908791 1.547079 -0.442584
N -5.820362 0.459362 1.420992
C 1.154289 0.017679 0.095968
C 2.229539 -1.059801 -0.232466
C -0.119660 -0.392952 -0.699550
C 1.482116 -2.238847 -0.867568
C 3.074469 0.999221 -0.909672
C 1.307531 -3.448199 0.070391
C 3.398261 1.863887 -2.114852
C -2.492675 0.300750 -0.213830
C -1.613626 -1.239383 1.220532
C -3.494995 -0.030952 0.751404
C -2.920250 -1.009730 1.648405
C 4.078069 2.471473 0.822344
C -4.741566 0.651552 0.585213
C 4.826523 2.317951 2.145372
C -3.854957 1.761101 -1.290686
H 0.952507 0.129049 1.173017
H 2.861123 -1.323171 0.632964
H -0.309264 0.332746 -1.509521
H 2.005866 -2.566919 -1.785342
H 2.220865 -4.077231 0.050919
H 0.452086 -4.043407 -0.286607
H 4.442082 1.692055 -2.423098
H 2.722682 1.604825 -2.944208
H 3.261317 2.929705 -1.871211
H -0.857027 -1.932616 1.589541
H -3.391443 -1.502341 2.497794
H 1.798048 -2.917405 1.977241
H 4.621434 3.155025 0.138900
H 3.051341 2.856065 0.976221
H 4.948806 3.303560 2.630655
H 4.273131 1.655961 2.833747
H 5.827737 1.884918 1.977278
H -4.029389 2.479105 -2.097475
H -5.782131 -0.189974 2.200628
H -6.672438 0.981713 1.227632


