%chk=000196854.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196854

0 1
O -1.091744 -0.056339 0.274407
O 0.452155 -3.388436 1.130584
O -4.101430 0.574266 1.642772
C 1.001608 0.203258 -0.917670
C -0.396156 -0.532444 -0.914196
C 1.681736 -0.121503 0.446713
C 2.953144 0.717311 0.792049
C 0.768404 1.729942 -1.012951
C -0.234714 -2.068223 -0.755091
C -1.293346 -0.168545 -2.122314
C 1.944103 -1.628302 0.572787
C 2.643266 2.224529 0.596040
C 2.050762 2.532203 -0.780278
C 1.802572 -0.274472 -2.138170
C -2.354044 0.575718 -0.040098
C -2.430488 0.697764 -1.569828
C 0.681378 -2.440868 0.412817
C 4.186065 0.322926 -0.038501
C 3.292096 0.503326 2.286326
C -1.572400 -2.788797 -0.593663
C -3.477907 -0.281339 0.617755
C -2.447605 1.872787 0.729202
C -3.425595 1.784111 1.645974
H 0.915014 0.152210 1.229834
H 0.008331 2.019952 -0.255617
H 0.336465 1.993027 -1.994920
H 0.269563 -2.449666 -1.682577
H -1.693248 -1.074136 -2.613487
H -0.725426 0.364587 -2.904822
H 2.398742 -1.853726 1.562660
H 2.692452 -1.964963 -0.172166
H 3.563236 2.816953 0.751908
H 1.936381 2.557947 1.381094
H 2.791041 2.315198 -1.573736
H 1.832823 3.614549 -0.860070
H 2.806654 0.182613 -2.139715
H 1.948724 -1.358533 -2.147644
H 1.318836 0.006606 -3.078697
H -2.313038 1.753303 -1.878726
H -3.411996 0.382743 -1.961020
H 4.483928 -0.713864 0.143042
H 3.993019 0.430457 -1.115852
H 5.046776 0.954199 0.204388
H 3.541292 -0.542591 2.497176
H 4.151005 1.108840 2.590829
H 2.453312 0.772173 2.936853
H -2.107055 -2.414517 0.294365
H -2.219934 -2.661427 -1.465119
H -1.418053 -3.865331 -0.430821
H -4.296572 -0.570444 -0.050483
H -3.065868 -1.154361 1.157215
H -1.767133 2.679737 0.544477
H -3.818632 2.452794 2.390467


%chk=000196854-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196854

0 1
O -1.133524 -0.120018 0.357635
O 0.257317 -3.286665 1.342387
O -4.362791 0.576442 1.578700
C 1.003305 0.178814 -0.933885
C -0.419520 -0.555838 -0.884110
C 1.713503 -0.107956 0.445704
C 3.014472 0.725385 0.763066
C 0.793653 1.718006 -1.066156
C -0.213582 -2.113405 -0.757115
C -1.376178 -0.160444 -2.052653
C 1.909126 -1.631388 0.673929
C 2.699713 2.235541 0.530668
C 2.087622 2.533236 -0.851752
C 1.791356 -0.335067 -2.177208
C -2.409437 0.618176 0.057860
C -2.345037 0.896173 -1.469180
C 0.616498 -2.417156 0.504794
C 4.264919 0.306947 -0.059154
C 3.369659 0.558608 2.269855
C -1.489816 -2.973489 -0.780682
C -3.622723 -0.237147 0.558002
C -2.532347 1.857845 0.923787
C -3.618852 1.757678 1.732043
H 0.970702 0.226931 1.200363
H 0.058967 2.034806 -0.301415
H 0.368798 1.957936 -2.061228
H 0.422793 -2.405447 -1.620377
H -1.940914 -1.041481 -2.397257
H -0.826976 0.234995 -2.923329
H 2.295043 -1.840305 1.684999
H 2.648310 -2.035394 -0.049005
H 3.628288 2.823436 0.675554
H 1.985814 2.568516 1.313546
H 2.824045 2.318544 -1.650992
H 1.855206 3.613199 -0.933367
H 2.530675 0.408843 -2.516366
H 2.341969 -1.271953 -1.985439
H 1.115043 -0.519727 -3.031931
H -1.955987 1.914702 -1.635592
H -3.347027 0.847615 -1.928285
H 4.488345 -0.769061 0.061824
H 4.162937 0.512650 -1.137227
H 5.149011 0.865105 0.303511
H 3.770030 -0.445591 2.498289
H 4.143870 1.294664 2.559253
H 2.484115 0.727587 2.911171
H -2.189547 -2.660103 0.010863
H -2.003681 -2.939135 -1.756665
H -1.227462 -4.023554 -0.569161
H -4.347883 -0.492770 -0.231868
H -3.261350 -1.143921 1.068464
H -1.836941 2.694749 0.880314
H -4.021031 2.443090 2.478318


