%chk=000229957.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229957

0 1
O 3.599425 2.811066 0.297509
O -8.209399 0.325379 -0.633442
O -7.845943 0.294307 1.498706
N -0.987125 -0.162094 0.256026
N -7.474180 0.248659 0.337751
C 3.714570 1.522113 0.887230
C 2.608876 0.567663 0.439511
C 4.979649 0.783915 0.463973
C 3.179861 -0.612829 -0.128748
C 4.645458 -0.478058 -0.113608
C 1.244592 0.726274 0.541986
C 2.366859 -1.637940 -0.585760
C 6.296400 1.182793 0.585197
C 5.640187 -1.335831 -0.556496
C 0.418260 -0.321838 0.056129
C 0.972115 -1.486044 -0.496060
C 7.304882 0.309707 0.128956
C 6.981595 -0.926104 -0.427909
C -1.850887 -0.397620 -0.677963
C -3.297298 -0.223185 -0.387905
C -4.193495 -0.130412 -1.469240
C -3.777388 -0.157474 0.930866
C -6.023639 0.086657 0.086918
C -5.558220 0.026360 -1.235994
C -5.142010 -0.002433 1.173984
H 3.680403 1.739673 1.978972
H 0.800495 1.621818 0.978710
H 2.791629 -2.546312 -1.008675
H 6.553602 2.148248 1.018568
H 5.399134 -2.301635 -0.992908
H 0.325656 -2.290845 -0.841689
H 8.348118 0.610294 0.217163
H 7.774497 -1.590018 -0.771508
H 3.649555 2.750739 -0.682349
H -1.620436 -0.713421 -1.710332
H -3.826264 -0.175247 -2.495262
H -3.073055 -0.220765 1.767721
H -6.268254 0.102388 -2.067187
H -5.529329 0.051151 2.197960


%chk=000229957-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229957

0 1
O 3.700406 2.829427 0.826323
O -8.349374 -0.182878 -0.637538
O -7.923405 0.722605 1.413596
N -0.990488 -0.005330 0.237322
N -7.540158 0.208483 0.291629
C 3.793730 1.386953 1.120273
C 2.660243 0.537353 0.537852
C 5.041172 0.697444 0.561319
C 3.198557 -0.551670 -0.214341
C 4.672577 -0.453420 -0.198920
C 1.281258 0.702705 0.687558
C 2.331666 -1.493022 -0.812386
C 6.388215 1.056205 0.721278
C 5.663173 -1.261512 -0.797519
C 0.396879 -0.217402 0.047515
C 0.938251 -1.321278 -0.683567
C 7.383943 0.248955 0.112165
C 7.022259 -0.900000 -0.635073
C -1.885876 -0.386492 -0.642578
C -3.326493 -0.225891 -0.389326
C -4.262985 -0.639419 -1.378663
C -3.802916 0.335867 0.831428
C -6.085218 0.058878 0.055904
C -5.645663 -0.500816 -1.164405
C -5.179474 0.481519 1.059423
H 3.782244 1.367066 2.225641
H 0.856724 1.526961 1.268480
H 2.727498 -2.353780 -1.362520
H 6.663091 1.945553 1.298475
H 5.394574 -2.150270 -1.379366
H 0.260538 -2.065579 -1.117373
H 8.441622 0.512932 0.221019
H 7.805517 -1.513699 -1.093765
H 3.718726 2.948882 -0.158229
H -1.611323 -0.821992 -1.626199
H -3.900356 -1.070622 -2.319277
H -3.066447 0.647364 1.577891
H -6.383074 -0.811047 -1.908996
H -5.570718 0.910067 1.985750


