%chk=000246602.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246602

0 1
O 4.888535 0.651704 0.419644
O 4.378427 -1.377934 -0.440019
C -4.651295 -1.138624 -0.070430
C -4.902733 0.246025 0.535058
C -3.232953 -1.620470 0.258963
C -3.934551 1.276903 -0.058508
C -2.181746 -0.570870 0.017948
C -2.510084 0.795935 -0.099573
C -0.841145 -0.968795 -0.063111
C -1.485485 1.735315 -0.292596
C 0.181645 -0.023386 -0.247124
C -0.151121 1.335655 -0.362945
C 1.574074 -0.484767 -0.324522
C 2.631765 0.236796 0.076758
C 3.996970 -0.301947 -0.035045
C 6.294110 0.290679 0.384573
H -4.789960 -1.100824 -1.168690
H -5.394002 -1.865143 0.308140
H -4.779415 0.204358 1.635046
H -5.947073 0.561485 0.354693
H -3.007085 -2.533281 -0.329199
H -3.181528 -1.929393 1.325814
H -4.003923 2.223145 0.516113
H -4.248244 1.530890 -1.094688
H -0.586960 -2.024921 0.025727
H -1.731710 2.792153 -0.388904
H 0.629872 2.079013 -0.517656
H 1.716101 -1.495480 -0.736032
H 2.554223 1.237393 0.507886
H 6.463956 -0.585607 1.018072
H 6.780870 1.186488 0.783157
H 6.594664 0.084204 -0.647449


%chk=000246602-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246602

0 1
O 5.053759 0.721427 0.033200
O 4.317598 -1.497245 0.116281
C -4.676597 -1.172147 -0.297342
C -5.022268 0.172555 0.379919
C -3.279252 -1.652360 0.151929
C -4.025413 1.267022 -0.062070
C -2.214787 -0.560264 0.068051
C -2.568892 0.817107 -0.004070
C -0.845797 -0.914704 0.084256
C -1.531943 1.789255 -0.049248
C 0.195022 0.052056 0.037985
C -0.176479 1.427425 -0.028780
C 1.586879 -0.408908 0.060818
C 2.719332 0.360973 0.035181
C 4.051657 -0.267511 0.066523
C 6.442171 0.211794 0.062047
H -4.694692 -1.041580 -1.398056
H -5.433506 -1.939509 -0.048784
H -4.979335 0.046274 1.480422
H -6.053710 0.483430 0.128766
H -2.960503 -2.527542 -0.446286
H -3.343313 -2.005959 1.202528
H -4.155957 2.180085 0.550702
H -4.260451 1.565340 -1.105985
H -0.573689 -1.977945 0.135249
H -1.806462 2.850559 -0.101509
H 0.593578 2.205443 -0.064392
H 1.741856 -1.497528 0.105325
H 2.699696 1.454119 -0.007319
H 6.621587 -0.362601 0.987017
H 7.074122 1.110417 0.024961
H 6.629990 -0.442778 -0.806218


