%chk=000206066.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206066

0 1
O 5.225998 0.601371 0.561007
O 4.072601 1.927117 -0.974891
N 0.080897 -0.479256 0.141890
C -1.309283 -0.096716 0.029833
C 1.110667 -0.097283 -0.742949
C 0.608012 -1.293703 1.167292
C 2.297163 -0.683987 -0.271718
C 1.979629 -1.424855 0.922452
C -1.759350 1.084356 0.681457
C -2.198084 -0.915068 -0.719420
C 3.667803 -0.532748 -0.906486
C 0.872287 0.772222 -1.948011
C -3.127599 1.430290 0.573890
C -3.558152 -0.531452 -0.799996
C -0.251344 -1.859944 2.262516
C -4.041787 0.638224 -0.163726
C -0.794592 1.952296 1.467835
C -1.696179 -2.165798 -1.416970
C -5.499443 1.046957 -0.288898
C 4.311157 0.783352 -0.491277
H 2.680109 -1.990057 1.536618
H 3.589505 -0.526173 -2.008319
H 4.324333 -1.364301 -0.604420
H 0.894137 0.189345 -2.891069
H -0.111151 1.270876 -1.895514
H 1.651927 1.550537 -2.023634
H -3.485776 2.337812 1.076070
H -4.253473 -1.158727 -1.371785
H 0.373253 -2.461119 2.944070
H -0.745120 -1.072085 2.864380
H -1.055480 -2.515423 1.874371
H -0.301458 1.382633 2.276780
H 0.017467 2.337242 0.823302
H -1.314741 2.814147 1.918734
H -2.524538 -2.710478 -1.900625
H -1.193103 -2.851252 -0.710665
H -0.947582 -1.918275 -2.192509
H -6.155160 0.170911 -0.436147
H -5.847143 1.588104 0.608666
H -5.650218 1.719488 -1.155853
H 5.581010 1.489217 0.840221


%chk=000206066-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206066

0 1
O 5.168630 0.646728 0.586497
O 4.137241 1.902340 -1.070917
N 0.083707 -0.480431 0.155279
C -1.307054 -0.103057 0.036605
C 1.107128 -0.090989 -0.733651
C 0.618884 -1.293374 1.176759
C 2.299260 -0.672210 -0.269209
C 1.989750 -1.416420 0.926163
C -1.766123 1.073345 0.690287
C -2.186311 -0.917620 -0.727847
C 3.669539 -0.529287 -0.907731
C 0.845456 0.789304 -1.923667
C -3.132671 1.420213 0.566819
C -3.545770 -0.534498 -0.822039
C -0.233283 -1.868758 2.272774
C -4.037457 0.631903 -0.186246
C -0.814967 1.931548 1.504119
C -1.677687 -2.165891 -1.425392
C -5.493560 1.041166 -0.326959
C 4.318942 0.791728 -0.521663
H 2.696359 -1.978674 1.535886
H 3.595382 -0.546698 -2.009200
H 4.323351 -1.356187 -0.586812
H 0.252838 0.277915 -2.708261
H 0.288481 1.704368 -1.646701
H 1.801824 1.113705 -2.364984
H -3.497402 2.324806 1.069623
H -4.234121 -1.159864 -1.404300
H 0.395279 -2.475229 2.945865
H -0.723443 -1.085784 2.883804
H -1.039496 -2.520968 1.883776
H -0.419400 1.380382 2.377697
H 0.064775 2.238572 0.909584
H -1.319209 2.840750 1.872624
H -2.508635 -2.737952 -1.871617
H -1.131148 -2.827449 -0.729084
H -0.965222 -1.912365 -2.232751
H -6.146338 0.166648 -0.494781
H -5.854515 1.570360 0.572553
H -5.632624 1.724839 -1.187116
H 5.526808 1.540884 0.840717


