%chk=000210604.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210604

0 1
O -2.473000 1.193136 1.609496
O 0.925107 0.634253 -1.877192
O 0.572979 2.676601 0.936836
O -0.289822 -2.273409 -0.017374
O -3.105387 -0.420052 -1.245658
O -3.442519 -1.623273 0.648147
O 2.804093 1.768001 -1.521065
C -0.770638 0.869688 -0.174734
C -1.888868 0.242526 0.660136
C 0.344052 1.275494 0.886666
C -1.506682 0.224904 2.132116
C -0.119455 0.797554 2.292319
C -0.116625 -0.112286 -1.183703
C 1.709325 0.700181 0.427595
C 1.668765 -0.847750 0.469910
C 0.620749 -1.335832 -0.566775
C -1.323137 2.070549 -0.936047
C -2.893210 -0.714997 0.075090
C 1.926763 1.126763 -1.022076
C 3.045808 -1.442557 0.239343
C 3.675036 -2.047276 1.454633
C 3.651597 -1.431833 -0.949071
C -4.045471 -1.280799 -1.953532
H -1.913415 -0.467302 2.866655
H -0.116530 1.657574 2.995995
H 0.577047 0.060675 2.733810
H -0.818845 -0.406266 -1.994006
H 2.530433 1.107670 1.064625
H 1.314708 -1.163052 1.487166
H 1.089550 -1.929963 -1.392849
H -0.532289 2.585605 -1.503104
H -2.092283 1.756280 -1.658789
H -1.797699 2.797829 -0.264571
H -0.270171 3.174533 1.061628
H -0.637407 -1.998126 0.854829
H 3.742211 -1.327609 2.281055
H 3.104393 -2.917681 1.809113
H 4.698395 -2.400546 1.261082
H 4.633448 -1.850313 -1.119193
H 3.233982 -0.999067 -1.848041
H -3.658359 -2.305178 -1.969115
H -4.065860 -0.830684 -2.952090
H -5.023568 -1.239365 -1.463360


%chk=000210604-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210604

0 1
O -2.481656 1.293165 1.643194
O 1.029554 0.779584 -1.856716
O 0.645173 2.726532 1.019061
O -0.520635 -2.091867 -0.098962
O -3.081340 -0.507667 -1.272640
O -3.664903 -1.394559 0.800895
O 3.012793 1.827874 -1.304801
C -0.764292 0.938248 -0.161366
C -1.889034 0.277236 0.655104
C 0.353898 1.292492 0.940920
C -1.534475 0.203183 2.105436
C -0.138186 0.747298 2.327523
C -0.090026 0.011177 -1.218026
C 1.713342 0.673402 0.482926
C 1.638952 -0.896222 0.400639
C 0.561165 -1.272373 -0.665823
C -1.314501 2.185362 -0.900619
C -2.949775 -0.640579 0.108101
C 2.026962 1.185655 -0.922069
C 3.028799 -1.509679 0.200443
C 3.790137 -1.793292 1.483477
C 3.574053 -1.741269 -1.022672
C -4.114735 -1.371675 -1.895239
H -1.994828 -0.538697 2.764276
H -0.145227 1.571233 3.062807
H 0.523923 -0.036896 2.734225
H -0.787022 -0.217405 -2.035367
H 2.507495 1.004995 1.170795
H 1.250095 -1.255085 1.372635
H 1.024497 -1.804750 -1.517059
H -0.501003 2.763306 -1.364838
H -2.015386 1.862432 -1.689425
H -1.874624 2.834464 -0.206041
H -0.200699 3.211133 1.198143
H -0.198532 -3.016473 0.040351
H 3.910226 -0.872346 2.088054
H 3.248960 -2.522834 2.118420
H 4.797125 -2.194167 1.280770
H 4.585870 -2.149638 -1.120119
H 3.061447 -1.500090 -1.960797
H -3.855743 -2.432903 -1.744421
H -4.100796 -1.105358 -2.961216
H -5.099849 -1.168346 -1.444076


