%chk=000280581.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280581

0 1
O -1.843751 -1.201984 -0.993615
O -1.312759 2.172310 -1.422364
O -4.264988 -2.772295 -0.046144
O 4.680033 -0.881095 1.378053
N 0.368972 -0.656637 -0.417726
N -3.294507 1.273844 1.261746
N 1.830439 -1.975965 0.753325
N 1.899305 1.342008 -0.723871
N 4.080270 1.036959 0.258852
C -2.856641 0.758030 -0.048263
C -1.403564 1.113398 -0.485434
C -0.845702 -0.197373 -1.125484
C -2.863036 -0.793379 -0.017922
C -4.168916 -1.426303 -0.508230
C 1.563565 0.062656 -0.279176
C 0.599220 -1.916483 0.242072
C -3.504213 2.746678 1.263934
C 2.456845 -0.763093 0.448667
C 3.818037 -0.305951 0.772688
C 3.233329 1.758758 -0.401403
H -3.568778 1.135435 -0.828945
H -0.783175 1.486461 0.362898
H -0.640925 -0.117712 -2.221966
H -2.555471 -1.217528 0.963590
H -4.254227 -1.395574 -1.609417
H -5.047021 -0.935033 -0.035225
H -2.632664 1.012755 2.002575
H -1.987033 2.092953 -2.134340
H -0.168653 -2.676409 0.272618
H -3.784986 3.060116 2.284857
H -4.354087 3.002113 0.608360
H -2.633520 3.340884 0.944917
H 1.238770 1.918289 -1.239297
H -3.593735 -3.334879 -0.494180
H 3.489166 2.767248 -0.765148


%chk=000280581-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000280581

0 1
O -1.849197 -1.311248 -0.746718
O -0.898471 2.221141 -0.896522
O -4.249588 -2.848164 0.003057
O 5.007479 -1.034105 0.777261
N 0.470650 -0.775972 -0.389549
N -3.544185 1.479611 1.031353
N 2.135596 -2.185082 0.306882
N 1.823012 1.335804 -0.504117
N 4.147529 1.066054 0.119119
C -2.856251 0.771511 -0.037609
C -1.314309 0.992991 -0.205689
C -0.818872 -0.296604 -0.930207
C -2.926477 -0.763936 0.147207
C -4.239648 -1.414039 -0.278406
C 1.630240 -0.015329 -0.268489
C 0.844938 -2.099158 -0.036765
C -3.791951 2.923827 0.853933
C 2.655006 -0.881131 0.163697
C 4.016094 -0.365735 0.390769
C 3.131444 1.797346 -0.280633
H -3.347487 1.035562 -1.001267
H -0.846695 1.069140 0.791326
H -0.703846 -0.119049 -2.019671
H -2.691294 -1.049220 1.194068
H -4.418173 -1.208065 -1.355710
H -5.063335 -0.986486 0.316099
H -3.209771 1.227599 1.968586
H -1.468358 2.378804 -1.690977
H 0.123083 -2.909589 -0.047974
H -4.404714 3.290061 1.695354
H -4.377185 3.083618 -0.071090
H -2.873311 3.547600 0.792655
H 1.050085 1.961176 -0.783996
H -3.520913 -3.274642 -0.516326
H 3.274476 2.868908 -0.468650


