%chk=000189323.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189323

0 1
O 0.344400 -1.860214 -0.017498
O 1.022009 -0.264417 -1.470925
O -4.975107 1.290348 -1.109035
O -5.402536 2.374507 0.828107
C 3.923353 -1.269275 -0.652759
C 3.577549 -0.104277 0.274951
C 2.582756 -1.264581 0.124654
C 3.907919 -1.024434 -2.141017
C 4.944900 -2.295036 -0.224276
C 4.259867 0.101646 1.570678
C 1.302189 -1.019644 -0.568045
C 5.443395 0.724317 1.697865
C 6.209595 1.266155 0.532271
C 6.075909 0.932824 3.039154
C -1.020434 -1.743463 -0.510356
C -1.808104 -0.837448 0.394319
C -2.859766 -0.074141 -0.127304
C -1.505560 -0.768664 1.762844
C -3.610334 0.744395 0.727753
C -2.251777 0.056115 2.608851
C -3.307499 0.813715 2.096917
C -4.735171 1.567865 0.219076
C -6.028598 2.050021 -1.783856
C -5.512918 3.426343 -2.148013
H 3.292617 0.848331 -0.206242
H 2.484834 -1.977834 0.958245
H 3.094953 -0.345017 -2.448989
H 4.848953 -0.573984 -2.477916
H 3.766423 -1.957336 -2.700875
H 5.945323 -2.032485 -0.591245
H 5.019959 -2.379127 0.868138
H 4.696643 -3.289386 -0.616053
H 3.719300 -0.271314 2.439648
H 5.841066 2.266026 0.259587
H 7.282456 1.359656 0.738256
H 6.102821 0.631010 -0.358822
H 5.428791 0.623624 3.869884
H 6.323658 1.991228 3.200924
H 7.010777 0.362079 3.127146
H -1.004250 -1.393446 -1.561827
H -1.376372 -2.791261 -0.457661
H -3.102607 -0.104113 -1.193143
H -0.674970 -1.360030 2.155728
H -2.009490 0.109189 3.669607
H -3.898954 1.462263 2.748775
H -6.215957 1.405822 -2.662011
H -6.913817 2.087506 -1.123980
H -4.550335 3.370533 -2.672946
H -5.354793 4.041176 -1.248728
H -6.217564 3.962329 -2.793954


%chk=000189323-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189323

0 1
O 0.330596 -2.674733 0.562170
O 0.530386 -1.556489 -1.486649
O -2.447576 1.907985 -0.760357
O -3.841965 2.640674 0.962707
C 3.667460 -1.748682 -0.884455
C 3.132182 -0.378245 -0.454170
C 2.426268 -1.689831 0.062785
C 3.484789 -2.162760 -2.343283
C 4.946247 -2.294256 -0.248107
C 3.825648 0.531786 0.493556
C 1.046119 -1.941801 -0.403136
C 3.558945 1.859885 0.680846
C 2.464044 2.628653 -0.037528
C 4.370140 2.681200 1.668964
C -1.121605 -2.929569 0.260301
C -1.998598 -1.894985 0.932370
C -2.158642 -0.611287 0.356147
C -2.661394 -2.194996 2.149201
C -2.962714 0.362175 0.997348
C -3.472526 -1.227636 2.786231
C -3.623284 0.051308 2.214879
C -3.146134 1.734606 0.436918
C -2.526511 3.260833 -1.388221
C -1.465386 4.193990 -0.797013
H 2.528736 0.109670 -1.228880
H 2.606624 -1.975056 1.102476
H 2.529269 -1.798744 -2.755018
H 4.311122 -1.753192 -2.954453
H 3.503136 -3.264808 -2.442694
H 5.837153 -1.866994 -0.746215
H 5.017831 -2.067040 0.829782
H 4.987322 -3.393353 -0.361049
H 4.632750 0.088996 1.094852
H 1.767304 3.078531 0.698004
H 2.892134 3.468597 -0.620514
H 1.867632 2.002649 -0.720285
H 5.150484 2.077480 2.163973
H 3.718882 3.113870 2.454723
H 4.865892 3.535369 1.165359
H -1.245774 -2.921757 -0.836521
H -1.296313 -3.938741 0.665257
H -1.655290 -0.364559 -0.583470
H -2.538488 -3.187214 2.600555
H -3.981893 -1.471796 3.724417
H -4.241587 0.820699 2.688819
H -2.351643 3.059650 -2.457168
H -3.543795 3.661800 -1.234409
H -0.457825 3.752951 -0.892320
H -1.670548 4.395021 0.267795
H -1.474101 5.158246 -1.338619


