%chk=000199389.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199389

0 1
O -5.208318 -0.559780 1.169282
O 0.268874 -0.530947 -2.186246
O -1.663322 1.573997 1.435150
O 2.415079 3.031848 0.035458
N -0.728590 0.430442 -0.367300
N 0.389723 2.278762 0.728060
C -1.971194 -0.416516 -0.575302
C -3.173673 0.479345 -0.918614
C -2.236510 -1.269244 0.677549
C -4.422889 -0.378567 -1.134890
C -3.480976 -2.135822 0.469305
C -4.711661 -1.309933 0.055460
C 0.383690 0.210010 -1.239281
C 1.687880 0.922507 -0.906260
C -0.744467 1.417495 0.657862
C 1.578597 2.166342 -0.042993
C 2.630511 -0.063524 -0.243706
C 3.818319 -0.424103 -0.893739
C 2.316877 -0.611614 1.009066
C 4.691374 -1.332743 -0.287420
C 3.195132 -1.518199 1.607450
C 4.382267 -1.879957 0.961321
H -1.751347 -1.093531 -1.449089
H -2.963069 1.079088 -1.824221
H -3.359120 1.212586 -0.104661
H -2.375904 -0.618659 1.567710
H -1.361882 -1.907776 0.903446
H -5.300191 0.281566 -1.293390
H -4.322159 -0.979716 -2.058523
H -3.285433 -2.914224 -0.292559
H -3.713886 -2.678016 1.408546
H -5.578133 -1.977418 -0.166984
H 2.133100 1.252024 -1.894898
H -4.540299 0.086288 1.483636
H 0.323182 3.062329 1.399986
H 4.067093 -0.002708 -1.867304
H 1.395959 -0.336074 1.520302
H 5.615702 -1.613233 -0.792424
H 2.953789 -1.943514 2.581470
H 5.064977 -2.586910 1.431345


%chk=000199389-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000199389

0 1
O -5.089742 -0.566708 1.266300
O 0.268655 -0.347978 -2.305637
O -1.700179 1.613345 1.474120
O 2.421437 3.181533 0.046161
N -0.725822 0.507456 -0.367566
N 0.382185 2.321321 0.747142
C -1.943327 -0.359489 -0.576548
C -3.194735 0.478562 -0.939341
C -2.163416 -1.306313 0.630551
C -4.422152 -0.445078 -1.141040
C -3.407415 -2.199077 0.397643
C -4.664646 -1.352104 0.088743
C 0.363613 0.358452 -1.270575
C 1.691868 1.026853 -0.888822
C -0.741322 1.465840 0.669294
C 1.556382 2.275419 -0.022898
C 2.599733 -0.019368 -0.204840
C 3.689064 -0.564284 -0.925552
C 2.348280 -0.462689 1.118497
C 4.521024 -1.538605 -0.330420
C 3.182215 -1.435184 1.711837
C 4.270318 -1.976939 0.989616
H -1.681386 -0.975505 -1.456813
H -2.998543 1.049698 -1.865827
H -3.405103 1.215187 -0.143492
H -2.289589 -0.718340 1.557135
H -1.266875 -1.939381 0.768789
H -5.322888 0.168140 -1.324915
H -4.270702 -1.086867 -2.032588
H -3.224446 -2.888888 -0.450978
H -3.595453 -2.818162 1.293495
H -5.528543 -2.013619 -0.096435
H 2.173887 1.331037 -1.832041
H -4.368693 0.068502 1.512260
H 0.291716 3.084983 1.426256
H 3.885490 -0.228974 -1.949845
H 1.514619 -0.050084 1.698582
H 5.362804 -1.952144 -0.896159
H 2.984157 -1.767730 2.736689
H 4.916632 -2.730916 1.451823


