%chk=000182999.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182999

0 1
O 0.947952 2.658440 1.110537
O -4.080998 -0.078170 0.471705
O -3.114806 -3.192304 1.601796
O -3.176866 4.883861 -0.088278
O 0.226755 -2.340916 4.741056
O 6.104841 0.593764 -1.799449
O 1.357352 -2.346010 -4.624454
C 0.137920 0.399685 0.608087
C -0.907250 1.453258 0.362154
C 1.342872 1.222935 1.165854
C -2.142375 -1.255468 -0.299178
C -0.388831 -0.702801 1.494338
C -2.938655 0.071941 -0.387539
C -2.223954 1.367693 -0.063992
C -1.495919 -1.450542 1.049965
C -0.348132 2.727037 0.660161
C 2.603330 1.049731 0.368049
C -1.186182 -1.507986 -1.445101
C -2.965706 2.557158 -0.202968
C 0.208756 -0.984695 2.729465
C -2.010968 -2.450143 1.914447
C -1.037339 3.922337 0.529638
C -2.370012 3.791579 0.086482
C -0.317514 -2.011176 3.529900
C -1.434656 -2.760157 3.150105
C 3.254545 -0.192235 0.392648
C 3.137559 2.110170 -0.384571
C -0.505180 -2.737779 -1.472982
C -0.984411 -0.587734 -2.488080
C 4.435907 -0.387757 -0.324340
C 4.313946 1.941511 -1.107369
C 0.359182 -3.059080 -2.519468
C -0.127720 -0.882928 -3.545783
C 4.948406 0.687699 -1.065499
C 0.532832 -2.122122 -3.548300
H 0.448098 -0.063117 -0.372646
H 1.520803 1.064092 2.255129
H -2.952998 -2.051599 -0.409415
H -3.422339 0.148428 -1.397647
H -4.009446 2.528156 -0.515877
H 1.058590 -0.404300 3.078162
H -0.581562 4.875522 0.761617
H -3.824870 0.048805 1.413798
H -1.844162 -3.540890 3.786874
H 2.836313 -1.017635 0.971453
H 2.619782 3.074200 -0.394390
H -0.648672 -3.454604 -0.661685
H -1.489233 0.380096 -2.482655
H -3.561445 -2.862397 0.757363
H 4.939526 -1.348144 -0.306957
H 4.747131 2.746684 -1.697276
H 0.878990 -4.011316 -2.533023
H 0.039300 -0.180489 -4.360309
H -2.716091 5.731923 0.134951
H 0.998783 -1.767137 4.977666
H 6.511413 -0.305583 -1.744982
H 1.789909 -3.233495 -4.584187


%chk=000182999-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182999

0 1
O 0.888579 2.755693 0.492736
O -4.047978 -0.362948 0.926238
O -3.239461 -2.783667 2.031868
O -3.515102 4.773362 -0.386159
O 0.868815 -2.449251 4.509175
O 6.703421 0.401341 -0.774051
O 0.911170 -2.233980 -5.040027
C 0.141814 0.413975 0.407706
C -1.018096 1.407290 0.210394
C 1.283360 1.350540 0.915608
C -2.187868 -1.343631 -0.231185
C -0.209545 -0.747791 1.341026
C -3.097423 -0.102299 -0.211499
C -2.396802 1.243198 -0.065778
C -1.408621 -1.462284 1.083785
C -0.490219 2.719677 0.258484
C 2.690987 1.070428 0.428295
C -1.329398 -1.515579 -1.494614
C -3.200131 2.402547 -0.255762
C 0.568969 -1.072192 2.477347
C -1.925150 -2.304240 2.112002
C -1.257257 3.880267 0.076728
C -2.638209 3.695468 -0.181068
C 0.114503 -2.061633 3.385910
C -1.154458 -2.652249 3.238874
C 3.084399 -0.218932 -0.004320
C 3.662132 2.107050 0.448247
C -0.484333 -2.652195 -1.584109
C -1.398338 -0.651304 -2.618213
C 4.413825 -0.473219 -0.406980
C 4.987237 1.869223 0.041827
C 0.275627 -2.916726 -2.741308
C -0.645680 -0.901599 -3.784722
C 5.364199 0.574143 -0.384856
C 0.191052 -2.036513 -3.847987
H 0.424276 0.012296 -0.586987
H 1.253618 1.395020 2.024027
H -2.890321 -2.203097 -0.245593
H -3.736089 -0.077965 -1.115859
H -4.264157 2.310695 -0.496928
H 1.522000 -0.565060 2.670930
H -0.795269 4.871802 0.130775
H -4.118577 0.445714 1.491148
H -1.553401 -3.324881 4.001011
H 2.360099 -1.040322 -0.029503
H 3.364237 3.111556 0.764205
H -0.422639 -3.339329 -0.732068
H -2.031838 0.240940 -2.595784
H -3.795145 -2.052314 1.611793
H 4.701603 -1.479207 -0.739138
H 5.737474 2.665223 0.042889
H 0.917321 -3.806782 -2.786255
H -0.696442 -0.232181 -4.648394
H -3.035373 5.637127 -0.339980
H 1.725225 -1.955056 4.543162
H 6.869301 -0.528231 -1.069346
H 1.450583 -3.061925 -4.992720


