%chk=000290790.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290790

0 1
O 2.295912 3.047222 -0.220602
O 0.268540 1.210666 1.992816
C 2.272511 1.590062 -0.064805
C 0.935843 0.929260 -0.362878
C 3.079451 2.236709 -1.155365
C -0.135964 1.463357 0.631372
C 1.113310 -0.571856 -0.341786
C -1.473373 0.786930 0.436230
C 1.094862 -1.284843 -1.550287
C 1.318155 -1.258459 0.864189
C -2.298668 1.197485 -0.621616
C -1.894758 -0.234199 1.297190
C 1.284066 -2.669807 -1.549016
C 1.506382 -2.642271 0.860082
C 1.492734 -3.350796 -0.345876
C -3.537662 0.581794 -0.815724
C -3.136832 -0.844494 1.099871
C -3.958274 -0.439201 0.043622
H 2.773928 1.240494 0.844999
H 0.586228 1.242370 -1.383688
H 4.156160 2.353742 -1.054005
H 2.719836 2.264504 -2.180785
H -0.224849 2.570081 0.501019
H 0.927695 -0.766610 -2.491952
H 1.306538 -0.705089 1.807649
H 0.839286 1.940234 2.308831
H -1.981083 1.994211 -1.290829
H -1.246896 -0.541990 2.120966
H 1.266339 -3.219043 -2.488683
H 1.661426 -3.170271 1.799453
H 1.640031 -4.428551 -0.347329
H -4.177614 0.898869 -1.636942
H -3.462321 -1.638062 1.770166
H -4.923937 -0.916451 -0.110089


%chk=000290790-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290790

0 1
O 2.285569 3.106809 0.047111
O 0.299980 1.378562 2.016865
C 2.303983 1.584474 -0.010913
C 0.971779 0.923784 -0.362833
C 3.104920 2.374810 -0.993578
C -0.130931 1.491419 0.610806
C 1.122351 -0.594990 -0.366738
C -1.475018 0.801601 0.437980
C 0.958445 -1.322142 -1.572461
C 1.452645 -1.307514 0.817608
C -2.251428 1.078004 -0.715431
C -1.961667 -0.122275 1.392327
C 1.119628 -2.725652 -1.602419
C 1.611821 -2.710376 0.789929
C 1.450871 -3.425277 -0.419771
C -3.492244 0.434606 -0.917703
C -3.204178 -0.764987 1.191766
C -3.972226 -0.492924 0.036411
H 2.839260 1.134094 0.834723
H 0.673552 1.250835 -1.378488
H 4.190812 2.463605 -0.866579
H 2.734356 2.483569 -2.020823
H -0.228238 2.565226 0.350295
H 0.693747 -0.786402 -2.492788
H 1.547165 -0.761434 1.762501
H 0.881451 2.153414 2.219743
H -1.894766 1.808763 -1.453507
H -1.368799 -0.313889 2.290905
H 0.984792 -3.270669 -2.543624
H 1.858194 -3.247002 1.713421
H 1.576615 -4.513734 -0.439581
H -4.086140 0.660936 -1.810643
H -3.573204 -1.477686 1.938249
H -4.936094 -0.991563 -0.116566


