%chk=000206308.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206308

0 1
O 3.697606 0.461408 0.446718
O -0.525943 -1.990087 0.402614
O -3.292925 -1.316679 0.638587
O -4.002956 1.484688 0.074437
O 5.386539 -0.815246 -0.128239
C 1.426212 -0.064688 -0.167305
C -0.003120 0.268973 -0.138981
C 1.467978 3.132733 0.256378
C 0.569129 2.620061 -0.879413
C 2.082350 2.032971 1.137676
C -0.432252 1.588289 -0.434984
C 2.329779 0.755088 0.407324
C 1.862741 -1.341419 -0.823303
C 3.309220 -1.251886 -1.314430
C -0.970078 -0.689902 0.212657
C -1.778630 1.931106 -0.337864
C -2.344656 -0.365604 0.270844
C 4.221243 -0.588817 -0.323588
C -2.740327 0.962849 0.017006
C -0.862626 -2.574870 1.692624
C -3.511095 -2.324734 -0.392030
C -5.094083 0.625158 0.497473
H 2.280459 3.742369 -0.188970
H 0.888078 3.820615 0.904228
H 1.202869 2.183197 -1.683554
H 0.057271 3.484459 -1.350773
H 1.407408 1.819846 1.996985
H 3.033824 2.398369 1.585960
H 1.736784 -2.177717 -0.097233
H 1.189631 -1.593968 -1.668719
H 3.357311 -0.679195 -2.268062
H 3.701420 -2.262540 -1.558268
H -2.118798 2.946946 -0.534664
H -0.275440 -2.074301 2.467720
H -0.550275 -3.615780 1.561407
H -1.938118 -2.495521 1.892363
H -3.904312 -1.854202 -1.295990
H -4.250214 -2.980147 0.078057
H -2.575017 -2.855439 -0.599291
H -4.849747 0.129794 1.444120
H -5.303553 -0.110117 -0.283574
H -5.912388 1.345241 0.611657


%chk=000206308-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206308

0 1
O 3.720948 0.387994 0.555805
O -0.632556 -2.096903 0.400718
O -3.391138 -1.435082 0.303031
O -4.135528 1.318589 -0.294192
O 5.514873 -0.822975 -0.191033
C 1.424213 -0.163271 -0.104442
C -0.015599 0.206746 -0.135730
C 1.500117 3.103208 0.328172
C 0.600683 2.599092 -0.836913
C 1.971987 1.941578 1.251195
C -0.429228 1.545993 -0.447973
C 2.316768 0.679455 0.500040
C 1.952840 -1.432199 -0.766166
C 3.358663 -1.166714 -1.352425
C -1.024130 -0.761132 0.131840
C -1.802178 1.871388 -0.441184
C -2.407355 -0.438621 0.079977
C 4.305484 -0.574111 -0.319788
C -2.798362 0.903669 -0.175606
C -0.932788 -2.560129 1.776369
C -3.498302 -2.421523 -0.800553
C -5.060496 0.968089 0.806847
H 2.372322 3.630936 -0.103226
H 0.950149 3.836385 0.949196
H 1.265118 2.164783 -1.609831
H 0.091419 3.463284 -1.300776
H 1.152104 1.708282 1.956673
H 2.846295 2.255817 1.846966
H 1.991304 -2.260735 -0.033736
H 1.269733 -1.764533 -1.565094
H 3.281866 -0.438401 -2.185615
H 3.825379 -2.082145 -1.750724
H -2.134402 2.888505 -0.672922
H -0.368155 -1.955634 2.511091
H -0.595419 -3.607376 1.813449
H -2.016475 -2.495954 1.978907
H -3.796508 -1.912471 -1.735707
H -4.282168 -3.128738 -0.488434
H -2.536873 -2.947512 -0.938132
H -4.735326 1.457555 1.745184
H -5.111290 -0.123861 0.946883
H -6.036690 1.369975 0.495457


