%chk=000208761.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208761

0 1
O -1.254304 -1.414342 -0.990177
O -0.443808 4.485559 0.763179
O 5.559268 -1.832425 0.043167
O 5.672762 0.262657 0.570257
N 0.963367 1.906541 0.301297
N 5.059551 -0.738075 0.236514
C -1.217145 0.936160 -0.284222
C 0.810937 -0.464282 -0.317678
C -0.574203 -0.308234 -0.486869
C -0.380583 2.036784 0.128782
C 1.549855 0.704860 0.079831
C -1.030995 3.324525 0.354472
C 1.509208 -1.708722 -0.522268
C -2.618782 1.135281 -0.485716
C 2.984353 0.597486 0.261994
C 3.588930 -0.608779 0.053643
C 2.855506 -1.785018 -0.342829
C -2.391444 3.466561 0.158841
C -3.180723 2.364798 -0.268489
C -2.252815 -2.011935 -0.210807
C -2.422390 -1.788846 1.157456
C -3.039536 -2.914636 -0.943023
C 0.984933 4.564973 1.003028
C -3.426664 -2.508265 1.814684
C -4.029310 -3.618938 -0.258190
C -4.225522 -3.417374 1.115072
H 0.914737 -2.575257 -0.827609
H -3.219645 0.291150 -0.825261
H 3.545362 1.492528 0.562073
H 3.413314 -2.715827 -0.490376
H -2.861069 4.435677 0.330483
H -4.249628 2.526479 -0.421612
H -1.799559 -1.082553 1.699838
H -2.867275 -3.051729 -2.008222
H -3.582434 -2.355622 2.883279
H -4.655661 -4.330073 -0.797956
H 1.537994 4.345458 0.084540
H 1.272467 3.888812 1.813896
H 1.089381 5.617200 1.296701
H -5.002632 -3.972055 1.637277


%chk=000208761-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208761

0 1
O -1.306011 -1.410787 -1.026693
O -0.399324 4.527199 0.772476
O 5.601615 -1.877526 0.054998
O 5.695565 0.327118 0.636449
N 0.966127 1.937574 0.305605
N 5.049628 -0.726764 0.261451
C -1.233732 0.958321 -0.338284
C 0.802174 -0.455172 -0.350820
C -0.592967 -0.300899 -0.533937
C -0.379886 2.070789 0.110089
C 1.550149 0.721553 0.075032
C -1.016540 3.365441 0.334628
C 1.494333 -1.698782 -0.561924
C -2.627383 1.161265 -0.580259
C 2.965640 0.606331 0.272610
C 3.584712 -0.619769 0.053979
C 2.864646 -1.789905 -0.364824
C -2.392652 3.510880 0.096670
C -3.184580 2.422647 -0.362931
C -2.294229 -2.065470 -0.232006
C -2.414287 -1.871779 1.161458
C -3.122911 -2.971099 -0.928241
C 1.037342 4.655584 1.086032
C -3.397122 -2.605284 1.864483
C -4.096885 -3.696376 -0.208831
C -4.239919 -3.516404 1.187895
H 0.916857 -2.567995 -0.888341
H -3.241467 0.333884 -0.942575
H 3.538802 1.480037 0.590807
H 3.414654 -2.720863 -0.519269
H -2.836453 4.495476 0.269685
H -4.250606 2.587932 -0.550756
H -1.760433 -1.169673 1.687888
H -2.993782 -3.094679 -2.007519
H -3.498470 -2.462207 2.945742
H -4.743914 -4.401932 -0.741036
H 1.657553 4.445970 0.200887
H 1.329899 3.970183 1.896601
H 1.137026 5.706406 1.400428
H -4.997373 -4.080724 1.741349


