%chk=000189289.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189289

0 1
O 1.440595 -2.109088 -0.244977
O 4.203814 -0.617354 0.963530
O 4.182904 2.375714 -0.726258
O -2.700824 0.117912 0.043655
O 5.003191 -0.031478 -1.614780
O 0.591517 -4.175943 -0.175646
O -3.619166 0.969312 -1.832667
O -4.044356 0.627747 2.258309
C 1.886525 0.090517 0.634789
C 1.365911 1.548689 0.804739
C 3.352650 0.200499 0.140219
C 0.963248 -0.722510 -0.264283
C 3.826675 1.658326 0.457224
C 2.622755 2.410072 1.040387
C -0.513916 -0.769949 0.227027
C 0.538805 1.975044 -0.394592
C -1.351764 0.270458 -0.531449
C -0.942589 1.725343 -0.261658
C 3.610149 -0.218922 -1.318427
C -0.899141 -2.213756 0.029027
C 0.363983 -3.000927 -0.136072
C 1.064117 2.513075 -1.495373
C -2.110600 -2.759699 0.025489
C -3.782178 0.545803 -0.714400
C -5.046368 0.382967 0.051827
C -4.962370 -0.127619 1.470364
C -6.198602 0.702028 -0.543900
H 1.925365 -0.393686 1.645749
H 0.724895 1.600918 1.717929
H 1.025536 -0.419515 -1.334427
H 4.705866 1.633536 1.138054
H 2.536897 3.408935 0.563884
H 2.769592 2.599834 2.117970
H -0.575928 -0.544748 1.323960
H -1.417240 0.048897 -1.620406
H -1.294773 2.033100 0.746327
H -1.508835 2.382403 -0.961890
H 3.099809 0.442386 -2.045989
H 3.342195 -1.276867 -1.501831
H 3.892880 -1.552238 0.965165
H 4.909801 1.898980 -1.219430
H 2.131824 2.704116 -1.609986
H 0.487088 2.816555 -2.355725
H 5.545847 -0.508606 -0.936122
H -3.017050 -2.174943 0.152554
H -2.278246 -3.824911 -0.107167
H -4.670641 -1.196501 1.483617
H -5.918064 0.005031 2.018394
H -7.163693 0.631226 -0.055079
H -6.256063 1.062284 -1.569491
H -3.124429 0.537156 1.900438


%chk=000189289-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189289

0 1
O 1.487697 -2.185055 -0.025048
O 4.331019 -0.777379 0.645186
O 4.244375 2.438016 -0.859876
O -2.726887 0.129629 0.163625
O 4.886668 0.029552 -1.950089
O 0.526557 -4.305978 0.067924
O -3.485956 0.805950 -1.942399
O -4.493094 0.788988 2.237075
C 1.985750 0.105289 0.646438
C 1.493711 1.580266 0.862338
C 3.402713 0.189609 -0.007041
C 0.991616 -0.769521 -0.107554
C 3.946322 1.630043 0.328477
C 2.824670 2.344834 1.115012
C -0.470376 -0.788155 0.437976
C 0.582956 2.079978 -0.266722
C -1.311110 0.259060 -0.321949
C -0.899683 1.742267 -0.093413
C 3.477380 -0.103972 -1.523232
C -0.864937 -2.253178 0.266660
C 0.382684 -3.073679 0.094751
C 1.022446 2.807824 -1.327462
C -2.079000 -2.856797 0.292335
C -3.744308 0.463980 -0.766817
C -5.100489 0.344191 -0.142382
C -5.214932 -0.092436 1.312409
C -6.178886 0.641079 -0.917666
H 2.135378 -0.341649 1.651109
H 0.884190 1.604960 1.787960
H 0.967670 -0.512253 -1.183030
H 4.865338 1.502825 0.933831
H 2.773305 3.405105 0.818341
H 3.053737 2.307691 2.195677
H -0.464950 -0.538369 1.518957
H -1.312785 0.031890 -1.404983
H -1.209701 2.009369 0.938324
H -1.503290 2.351661 -0.788463
H 2.917173 0.636491 -2.114771
H 3.115844 -1.126135 -1.745945
H 3.883637 -1.666121 0.651042
H 4.832205 1.882102 -1.451761
H 2.080153 3.077103 -1.437758
H 0.325590 3.153815 -2.100927
H 5.417638 -0.510445 -1.302815
H -3.005591 -2.297635 0.437827
H -2.137180 -3.944498 0.165465
H -4.866975 -1.142369 1.425221
H -6.268821 -0.042916 1.629106
H -7.198239 0.586904 -0.520427
H -6.051504 0.943682 -1.963122
H -3.532131 0.733987 1.991190


