%chk=000298552.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298552

0 1
O -0.302560 0.751360 -0.158350
O -5.008332 -0.913770 -0.193922
O -5.371628 1.212634 -0.308760
N -4.627542 0.249136 -0.242155
C 1.340458 -0.876530 -0.036504
C 0.050531 -1.538947 -0.036104
C 1.069545 0.514450 -0.112166
C 3.690014 -0.342719 -0.003902
C 2.677113 -1.298080 0.017950
C -0.905324 -0.545362 -0.109292
C 3.383195 1.055174 -0.080816
C 2.061477 1.496669 -0.135873
C -0.156470 -2.996975 0.030862
C 5.116972 -0.787236 0.054013
C -2.341272 -0.581570 -0.143546
C 4.486961 2.061483 -0.102851
C -3.155785 0.491559 -0.217208
C -2.734660 1.911621 -0.277007
H 2.904940 -2.360630 0.076280
H 1.803038 2.549571 -0.194489
H 0.327914 -3.505580 -0.818867
H 0.283319 -3.418011 0.949915
H -1.217506 -3.283328 0.018287
H 5.674475 -0.460633 -0.835609
H 5.629583 -0.373915 0.934530
H 5.217449 -1.879102 0.110032
H -2.771591 -1.600300 -0.103832
H 5.152455 1.906286 -0.965120
H 4.120144 3.094990 -0.163882
H 5.107131 1.994612 0.803463
H -2.133353 2.181503 0.608744
H -3.579761 2.617771 -0.333678
H -2.088332 2.093967 -1.153343


%chk=000298552-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298552

0 1
O -0.254410 0.836142 -0.154820
O -4.954222 -1.160350 -0.165537
O -5.558310 1.032637 -0.306792
N -4.657058 0.102931 -0.230890
C 1.355345 -0.833344 -0.036966
C 0.056840 -1.474570 -0.037542
C 1.125631 0.569130 -0.108710
C 3.757791 -0.369173 -0.001749
C 2.696124 -1.296824 0.016594
C -0.898452 -0.445871 -0.109254
C 3.485512 1.048426 -0.074796
C 2.151896 1.520181 -0.128984
C -0.195142 -2.954393 0.025573
C 5.193810 -0.859499 0.054790
C -2.325183 -0.521726 -0.139899
C 4.631644 2.042176 -0.094675
C -3.229878 0.513812 -0.219002
C -2.955071 1.991187 -0.295762
H 2.911178 -2.369543 0.072005
H 1.933354 2.590243 -0.184911
H 0.279858 -3.471337 -0.829504
H 0.236189 -3.388497 0.947250
H -1.269316 -3.199527 0.010447
H 5.770642 -0.537481 -0.833259
H 5.726703 -0.462689 0.940089
H 5.238462 -1.960396 0.102351
H -2.751103 -1.530759 -0.095349
H 5.305447 1.866770 -0.955116
H 4.263438 3.079243 -0.159939
H 5.255201 1.961042 0.816379
H -2.389031 2.328662 0.589590
H -3.901106 2.547938 -0.357207
H -2.334185 2.225557 -1.177603


