%chk=000219388.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219388

0 1
O -1.913392 0.093393 -1.896985
O 2.317507 -2.361208 0.564341
O 2.975800 2.304906 -0.159225
C -3.737089 1.003316 0.113467
C -2.243849 1.345191 0.132717
C -4.034100 -0.322972 0.827209
C -1.453703 0.533606 -0.870635
C -0.005430 0.318173 -0.491846
C -5.526987 -0.641923 0.817353
C 0.867871 1.397857 -0.485764
C 0.409536 -0.975529 -0.148252
C 1.752503 -1.162837 0.204165
C 2.216819 1.163051 -0.124503
C 2.681751 -0.103044 0.229261
C 1.479339 -3.544028 0.541437
C 4.382950 2.197545 0.174410
H -4.089307 0.948016 -0.939140
H -4.309959 1.823694 0.586155
H -1.828778 1.219272 1.153572
H -2.099443 2.421100 -0.106359
H -3.665843 -0.284412 1.870553
H -3.474304 -1.142834 0.334161
H -5.732326 -1.591863 1.323388
H -5.912981 -0.727232 -0.205722
H -6.111561 0.133702 1.324540
H 0.558259 2.401659 -0.759985
H -0.294221 -1.798895 -0.182215
H 3.708897 -0.303871 0.510514
H 1.103853 -3.723784 -0.470591
H 0.667740 -3.446886 1.267925
H 2.188455 -4.325958 0.843192
H 4.502026 1.861150 1.208350
H 4.720644 3.235155 0.053901
H 4.889824 1.533892 -0.532390


%chk=000219388-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219388

0 1
O -2.070495 -1.315630 -0.481380
O 2.934573 -2.483422 -0.035080
O 2.671582 2.349441 0.370047
C -3.834919 0.894013 -0.263073
C -2.307255 1.102519 -0.238040
C -4.400991 0.338899 1.065051
C -1.500532 -0.201116 -0.286663
C -0.003072 -0.137183 -0.122837
C -5.933830 0.163487 1.022840
C 0.678554 1.086020 0.057044
C 0.715836 -1.364834 -0.162353
C 2.116034 -1.345395 -0.016748
C 2.090085 1.084991 0.199144
C 2.816426 -0.123016 0.165433
C 2.277453 -3.781649 -0.221475
C 4.127797 2.409896 0.522994
H -4.091543 0.194361 -1.081348
H -4.325598 1.861596 -0.491422
H -2.013412 1.676871 0.663915
H -1.986114 1.720080 -1.103477
H -4.128720 1.024413 1.894502
H -3.921902 -0.634413 1.279376
H -6.322608 -0.229060 1.980450
H -6.226022 -0.544189 0.224398
H -6.440746 1.126635 0.820901
H 0.158017 2.046160 0.088970
H 0.141666 -2.283632 -0.307015
H 3.903139 -0.163564 0.273540
H 1.750247 -3.827875 -1.193512
H 1.562153 -3.989514 0.597096
H 3.092130 -4.520132 -0.202611
H 4.460400 1.854133 1.421185
H 4.359955 3.478432 0.639529
H 4.642213 2.010076 -0.372382


