%chk=000257085.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257085

0 1
O -1.888228 4.723407 -0.367383
N 2.844892 0.508895 -0.090648
N -0.761966 -1.632223 -0.162758
N -2.049008 0.815942 0.640931
N -0.806898 2.713560 -0.122189
C 0.381603 0.553575 0.165137
C 1.629330 1.371079 -0.254161
C 0.177114 -0.644016 -0.793129
C 3.361814 0.578746 1.317318
C 3.909636 0.905907 -1.072167
C -0.029970 -2.535321 0.787832
C -1.485729 -2.428458 -1.209755
C 4.558300 -0.372737 1.483035
C 5.116983 -0.037882 -0.942832
C -1.027953 -3.466443 1.494254
C -2.506987 -3.362276 -0.538693
C 5.673127 -0.031548 0.486402
C -1.827186 -4.289614 0.476347
C -0.851614 1.446505 0.197693
C -3.233710 1.572234 0.716367
C -1.979665 3.557075 -0.055369
C -3.208161 2.894403 0.399960
C -4.450988 0.836337 1.166095
H 0.547676 0.165212 1.206226
H 1.674829 2.317045 0.332924
H 1.518053 1.694225 -1.312663
H 1.173859 -1.086337 -1.030806
H -0.239363 -0.281382 -1.756298
H 2.540325 0.268631 1.998040
H 3.655266 1.609503 1.613902
H 4.238042 1.960086 -0.943756
H 3.479627 0.820807 -2.093643
H 0.490117 -1.897009 1.535438
H 0.757303 -3.135258 0.281311
H -0.794392 -3.020756 -1.847354
H -2.014719 -1.715519 -1.878930
H 4.224297 -1.416982 1.323724
H 4.936049 -0.317894 2.519935
H 5.899302 0.260657 -1.664005
H 4.811197 -1.066605 -1.218536
H -1.719975 -2.868123 2.118085
H -0.484221 -4.134064 2.188001
H -3.029206 -3.955076 -1.312479
H -3.284879 -2.759747 -0.031099
H 6.105035 0.959520 0.722607
H 6.501861 -0.757454 0.576841
H -1.158096 -4.999576 -0.046637
H -2.583485 -4.907703 0.994636
H -2.061309 -0.211932 0.773841
H -4.090365 3.524980 0.461815
H -4.350269 0.476884 2.201819
H -4.669628 -0.034708 0.530848
H -5.345868 1.478928 1.141030


%chk=000257085-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257085

0 1
O -1.819073 4.816542 0.620080
N 2.932927 0.563808 -0.160465
N -0.847731 -1.630769 -0.087000
N -1.994475 0.741175 0.446855
N -0.689728 2.758176 0.414629
C 0.453164 0.551215 0.250444
C 1.671727 1.343290 -0.290497
C 0.212443 -0.708254 -0.625905
C 3.510656 0.651543 1.207515
C 3.941946 0.947316 -1.184374
C -0.358678 -2.425281 1.082570
C -1.384482 -2.527530 -1.157997
C 4.729900 -0.281448 1.357883
C 5.176377 0.025422 -1.117735
C -1.481393 -3.301572 1.672930
C -2.533919 -3.406586 -0.626862
C 5.802875 0.049068 0.295467
C -2.076416 -4.234526 0.594984
C -0.790637 1.438446 0.366280
C -3.197227 1.430142 0.596764
C -1.885810 3.550998 0.570293
C -3.157773 2.809061 0.664096
C -4.454265 0.597235 0.677350
H 0.703642 0.218395 1.280205
H 1.711332 2.326530 0.224899
H 1.502721 1.561508 -1.362580
H 1.188252 -1.227502 -0.739649
H -0.118351 -0.380010 -1.630657
H 2.733217 0.376881 1.944749
H 3.820650 1.704625 1.438692
H 4.272768 2.010596 -1.047763
H 3.468176 0.877341 -2.181525
H 0.020211 -1.725595 1.848750
H 0.498121 -3.070733 0.770707
H -0.571098 -3.178645 -1.561501
H -1.738300 -1.889012 -1.989038
H 4.396166 -1.330365 1.233762
H 5.147005 -0.179705 2.378382
H 5.914935 0.345011 -1.878025
H 4.863536 -1.007653 -1.366408
H -2.277195 -2.646594 2.080321
H -1.075360 -3.888182 2.518508
H -2.890703 -4.067720 -1.439031
H -3.382879 -2.755638 -0.335475
H 6.217926 1.058598 0.495826
H 6.646105 -0.664591 0.359205
H -1.305168 -4.965057 0.275235
H -2.921243 -4.816645 1.007609
H -1.889876 -0.319619 0.332917
H -4.076137 3.389009 0.787168
H -4.421935 -0.092586 1.542150
H -4.586710 -0.016988 -0.234003
H -5.338419 1.244379 0.786366


