%chk=000212098.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212098

0 1
O 1.730029 2.120715 -0.738455
O 2.588070 -1.651468 1.748427
N -5.051420 0.880974 -0.328845
N 2.186188 0.239406 0.530825
N 0.310623 0.329463 -1.011243
C -6.495304 0.843924 1.674186
C -5.289459 -0.077953 1.933009
C -6.426064 1.216466 0.176561
C -4.563032 -0.213033 0.576466
C -4.155106 2.089777 -0.298590
C 3.407817 0.898938 1.101234
C 4.610050 0.722984 0.164000
C 5.865000 1.361662 0.771041
C -0.084127 -0.979839 -0.655671
C 1.438836 0.983544 -0.415328
C 0.698536 -1.694798 0.279409
C 1.880727 -1.107275 0.924928
C -0.521294 1.162556 -1.941743
C -2.870058 1.766485 -0.875875
C 7.076635 1.199989 -0.158043
C -1.223684 -1.597633 -1.228388
C -1.801638 1.490997 -1.364535
C 0.344961 -3.019357 0.616958
C 8.331865 1.832231 0.438759
C -1.547578 -2.899843 -0.878122
C -0.764936 -3.620414 0.044318
H -7.446154 0.341114 1.913546
H -6.450655 1.742382 2.311082
H -4.621931 0.348549 2.699852
H -5.607178 -1.062379 2.312295
H -7.132910 0.595751 -0.416411
H -6.697426 2.270447 -0.006696
H -3.463087 -0.205930 0.686226
H -4.829290 -1.170607 0.079788
H -4.644013 2.890228 -0.911732
H -4.015373 2.510358 0.728416
H 3.185093 1.978770 1.260165
H 3.610348 0.437769 2.096824
H 4.786078 -0.354022 -0.028370
H 4.388634 1.180032 -0.821728
H 5.686785 2.436882 0.967904
H 6.085806 0.904223 1.755318
H -0.642336 0.605868 -2.905351
H 0.050603 2.105746 -2.179428
H 7.257660 0.125305 -0.356935
H 6.859268 1.658085 -1.143049
H -1.855203 -1.055051 -1.931834
H 0.968453 -3.555712 1.341021
H 9.191402 1.712143 -0.230215
H 8.199695 2.906195 0.612909
H 8.597381 1.374793 1.398713
H -2.424520 -3.375686 -1.322748
H -1.035365 -4.641851 0.302953


%chk=000212098-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212098

0 1
O 1.709471 2.087370 -0.611205
O 2.857467 -1.924602 1.502493
N -5.249409 0.825229 -0.299304
N 2.252258 0.087381 0.475160
N 0.315658 0.232502 -0.940724
C -6.561932 1.303186 1.717652
C -5.418799 0.307021 2.106222
C -6.616507 1.225582 0.153933
C -4.835393 -0.178851 0.728965
C -4.326744 2.002383 -0.372491
C 3.441203 0.755037 1.077096
C 4.676218 0.702985 0.152273
C 5.901150 1.379993 0.806035
C -0.000739 -1.122077 -0.701288
C 1.440852 0.873930 -0.372848
C 0.858976 -1.898117 0.129935
C 2.052048 -1.293168 0.756462
C -0.528513 1.066655 -1.841743
C -2.991912 1.652174 -0.887383
C 7.153096 1.358395 -0.100592
C -1.149706 -1.734608 -1.274089
C -1.861111 1.383975 -1.299613
C 0.576074 -3.266228 0.365940
C 8.379587 2.028192 0.555882
C -1.413306 -3.094851 -1.027244
C -0.553080 -3.871959 -0.209429
H -7.530132 1.030746 2.172398
H -6.318474 2.328596 2.049837
H -4.645951 0.805710 2.717124
H -5.800954 -0.545595 2.694271
H -7.322919 0.433083 -0.157651
H -6.931592 2.167367 -0.327434
H -3.739241 -0.298361 0.730814
H -5.281268 -1.152892 0.454048
H -4.787633 2.739526 -1.057976
H -4.194418 2.521068 0.610486
H 3.163149 1.801990 1.281894
H 3.651103 0.228178 2.022768
H 4.913831 -0.353719 -0.077442
H 4.436075 1.210476 -0.801707
H 5.652835 2.432284 1.057639
H 6.136831 0.873118 1.764870
H -0.621770 0.549473 -2.815618
H 0.042289 1.998461 -2.003108
H 7.397362 0.307885 -0.358375
H 6.918393 1.868229 -1.056937
H -1.846366 -1.156207 -1.884999
H 1.268274 -3.820111 1.008273
H 9.261543 1.999568 -0.110148
H 8.171441 3.088097 0.795890
H 8.651497 1.518031 1.499231
H -2.303006 -3.551936 -1.474095
H -0.770403 -4.928692 -0.026352


