%chk=000271862.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271862

0 1
O 1.557647 -0.364693 -0.568756
O 6.382697 0.191118 1.111220
O -0.337187 -2.099980 -0.095744
O 4.578118 2.069993 2.399677
O 2.112761 -0.276216 1.627257
C -4.919933 -0.028164 -0.110220
C 4.806907 -1.213242 0.053100
C -2.170650 -0.593835 -0.129359
C 3.451767 -1.568112 0.026048
C -6.368697 0.275043 -0.103448
C -3.989863 0.967429 0.235078
C -4.468462 -1.311102 -0.458241
C -2.623804 0.685981 0.223485
C -3.102303 -1.592297 -0.459973
C 5.325512 0.121631 0.528417
C 4.517641 1.318582 0.164309
C -0.724786 -0.954744 -0.152181
C 0.263540 0.203472 -0.283811
C 5.762325 -2.150491 -0.369383
C 3.050775 -2.828328 -0.443876
C 2.366532 -0.676713 0.520540
C -6.983075 0.747949 1.066755
C -7.131556 0.089496 -1.267100
C 5.367748 -3.408966 -0.831642
C 4.011640 -3.747296 -0.872805
C 4.189864 2.307089 1.114931
C 4.114706 1.524062 -1.164789
C -8.351420 1.030563 1.070164
C -8.498419 0.379100 -1.257942
C 3.478208 3.470223 0.759476
C 3.419575 2.675537 -1.533246
C -9.109966 0.848357 -0.090799
C 3.106087 3.645593 -0.570105
H -4.339960 1.962725 0.507994
H -5.187009 -2.089635 -0.714734
H -1.918101 1.468676 0.501539
H -2.743448 -2.594672 -0.713816
H 0.304358 0.823866 0.634014
H 0.063276 0.833758 -1.169988
H 6.823334 -1.888613 -0.320865
H 1.982788 -3.078775 -0.472683
H -6.394537 0.885882 1.972873
H -6.656346 -0.273992 -2.177191
H 6.120188 -4.127796 -1.156475
H 3.701276 -4.726980 -1.236433
H 4.350209 0.766768 -1.916977
H -8.827722 1.393110 1.980105
H -9.088469 0.237976 -2.162457
H 3.234858 4.216970 1.507992
H 3.121741 2.821854 -2.568737
H -10.175672 1.070942 -0.085776
H 2.565317 4.545901 -0.865739
H 4.273688 2.774994 3.027318


%chk=000271862-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271862

0 1
O 1.427805 -0.542646 -1.250018
O 5.784017 -0.263615 2.085821
O -0.496367 -2.280561 -0.470710
O 4.206674 1.929898 2.970356
O 1.971439 -0.177516 0.992794
C -5.112525 -0.084437 -0.157838
C 4.721581 -1.266816 0.182441
C -2.333805 -0.712943 -0.477017
C 3.459936 -1.501538 -0.442358
C -6.556430 0.242033 0.006142
C -4.161194 0.928658 -0.466541
C -4.638801 -1.420772 -0.010027
C -2.796904 0.623552 -0.622358
C -3.278514 -1.729505 -0.166809
C 5.042071 -0.082907 1.077704
C 4.568440 1.279932 0.665982
C -0.897373 -1.094189 -0.631649
C 0.102091 0.023437 -0.997457
C 5.775541 -2.187110 -0.044847
C 3.287240 -2.623121 -1.293692
C 2.256625 -0.679990 -0.116795
C -6.967342 1.501496 0.525918
C -7.563041 -0.698017 -0.351854
C 5.600074 -3.301910 -0.890909
C 4.353882 -3.516522 -1.524124
C 4.210254 2.278066 1.621107
C 4.534223 1.626831 -0.710638
C -8.334780 1.809963 0.682641
C -8.930814 -0.389628 -0.197348
C 3.838521 3.576195 1.191845
C 4.178615 2.921977 -1.141648
C -9.324218 0.866134 0.321081
C 3.828085 3.898370 -0.181134
H -4.501020 1.959240 -0.614555
H -5.342091 -2.215286 0.261299
H -2.100041 1.433947 -0.862471
H -2.911260 -2.753620 -0.042626
H 0.157193 0.761400 -0.173379
H -0.189901 0.526251 -1.934211
H 6.731889 -2.006986 0.456489
H 2.302503 -2.795508 -1.736671
H -6.212418 2.230449 0.841644
H -7.275001 -1.662976 -0.783826
H 6.429401 -3.998247 -1.055669
H 4.208144 -4.383164 -2.177668
H 4.812221 0.868958 -1.451023
H -8.628614 2.781391 1.095308
H -9.689261 -1.124519 -0.488814
H 3.557796 4.333972 1.935521
H 4.176961 3.166067 -2.208557
H -10.386318 1.105435 0.442182
H 3.547308 4.909316 -0.496747
H 3.851206 2.671078 3.522712


