%chk=000253720.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253720

0 1
O -0.145558 -0.103637 -1.878446
N 2.166849 -1.451010 -0.278251
N -1.571321 -1.392748 -0.603381
N 1.692741 -2.931871 1.405473
N -0.807067 -2.868339 1.169108
C 0.775451 -1.570033 -0.219173
C 2.906544 -0.564105 -1.195859
C -0.264383 -0.931141 -0.988989
C -2.761409 -0.807886 -1.286379
C 0.501599 -2.505297 0.838089
C 3.163709 0.778432 -0.553168
C 2.679817 -2.275832 0.725169
C -3.389956 0.273402 -0.442292
C -1.767879 -2.306338 0.466822
C 4.359849 1.016510 0.137048
C 2.195652 1.787530 -0.655342
C -2.743320 1.511496 -0.311878
C -4.612511 0.049082 0.204261
C 4.587066 2.266895 0.719483
C 2.429146 3.034666 -0.070717
C -3.320451 2.519844 0.463178
C -5.186663 1.063530 0.976804
C 3.623878 3.275845 0.616061
C -4.542427 2.297550 1.107802
H 2.299150 -0.432598 -2.132832
H 3.856700 -1.059667 -1.501585
H -3.481777 -1.620195 -1.528810
H -2.428454 -0.381394 -2.270161
H 3.736797 -2.386068 0.931727
H -2.815452 -2.555436 0.707055
H 5.112224 0.235602 0.223408
H 1.259907 1.592872 -1.190304
H -1.789254 1.679497 -0.816311
H -5.121241 -0.907677 0.107553
H 5.515822 2.454165 1.256453
H 1.678181 3.819533 -0.149927
H -2.817755 3.480509 0.565972
H -6.137421 0.889945 1.478821
H 3.803560 4.248524 1.071368
H -4.990641 3.084845 1.711652


%chk=000253720-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253720

0 1
O -0.041641 -0.079634 -1.959766
N 2.200771 -1.460620 -0.244155
N -1.518516 -1.197669 -0.471991
N 1.680370 -2.835820 1.520809
N -0.791004 -2.632973 1.349729
C 0.807611 -1.485546 -0.150531
C 3.029124 -0.666854 -1.194546
C -0.204030 -0.850257 -0.954931
C -2.694701 -0.629843 -1.197161
C 0.504962 -2.343969 0.945414
C 3.377938 0.725019 -0.675098
C 2.666287 -2.280655 0.782924
C -3.548218 0.287510 -0.332113
C -1.731622 -2.042771 0.623771
C 4.562040 0.938406 0.073686
C 2.516024 1.819369 -0.940295
C -2.960428 1.377494 0.359855
C -4.945554 0.081284 -0.233231
C 4.879901 2.226100 0.560661
C 2.835032 3.107425 -0.455131
C -3.758703 2.244233 1.135938
C -5.747708 0.951853 0.540370
C 4.015205 3.313885 0.296958
C -5.155720 2.034873 1.228043
H 2.455733 -0.594878 -2.132558
H 3.946049 -1.253649 -1.382231
H -3.300439 -1.463580 -1.595888
H -2.261471 -0.079854 -2.052420
H 3.728569 -2.445011 0.951092
H -2.781149 -2.206377 0.886580
H 5.240477 0.098657 0.273300
H 1.603323 1.649686 -1.524069
H -1.879176 1.545396 0.288740
H -5.409399 -0.760289 -0.763262
H 5.798151 2.382174 1.137620
H 2.167009 3.949805 -0.667038
H -3.295040 3.082163 1.668280
H -6.827860 0.781943 0.609673
H 4.261951 4.313941 0.670842
H -5.774449 2.708032 1.831632


