%chk=000189696.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189696

0 1
O 2.662740 0.990066 -1.358968
O -3.189248 -1.241414 -0.718330
C 0.898396 0.352380 0.204856
C -0.661745 0.226738 -0.065712
C 1.360360 -1.063535 0.716946
C -1.340637 1.066498 1.049786
C 1.082853 1.555431 1.148563
C -0.906416 0.729928 -1.504622
C -0.309833 2.166671 1.386766
C -0.949143 -1.256168 0.080722
C 1.507261 0.701319 -1.162261
C 0.438068 0.678573 -2.235271
C 0.130816 -1.943062 0.482872
C 2.550968 -1.618251 -0.070861
C 1.677178 -1.103507 2.217993
C -2.711285 1.617365 0.679566
C -2.274167 -1.847865 -0.200029
H -1.460450 0.410673 1.947972
H 1.774713 2.301925 0.713701
H 1.551728 1.268370 2.104478
H -1.295884 1.765434 -1.493044
H -1.683825 0.128494 -2.010813
H -0.427471 2.520317 2.422910
H -0.458626 3.051271 0.742324
H 0.565200 1.517480 -2.943038
H 0.540356 -0.239243 -2.845173
H 0.203246 -3.005671 0.657874
H 2.304136 -1.814656 -1.120124
H 3.392288 -0.907041 -0.068628
H 2.920714 -2.556563 0.355189
H 2.548359 -0.479668 2.455484
H 0.833490 -0.745291 2.820344
H 1.910762 -2.120635 2.551703
H -2.656981 2.401119 -0.084420
H -3.355077 0.820869 0.270824
H -3.219401 2.043941 1.550131
H -2.392044 -2.906190 0.093590


%chk=000189696-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189696

0 1
O 2.634717 1.228404 -1.309104
O -3.302753 -1.349318 -0.618219
C 0.873154 0.380840 0.231662
C -0.689172 0.265622 -0.054514
C 1.376776 -1.079695 0.695189
C -1.366723 1.147044 1.053539
C 1.050013 1.560776 1.243747
C -0.902135 0.813183 -1.510140
C -0.323278 2.280943 1.261525
C -0.959604 -1.233175 0.036400
C 1.481784 0.760475 -1.143422
C 0.435996 0.556293 -2.239910
C 0.150639 -1.933896 0.421945
C 2.607027 -1.609118 -0.099393
C 1.712371 -1.188321 2.213629
C -2.795635 1.649648 0.771945
C -2.231950 -1.914795 -0.252983
H -1.389272 0.538342 1.983531
H 1.884211 2.218970 0.942543
H 1.278467 1.187993 2.255230
H -1.094854 1.900978 -1.478144
H -1.768231 0.340181 -1.999497
H -0.499234 2.836506 2.200735
H -0.395667 3.012429 0.432008
H 0.629144 1.209043 -3.106803
H 0.494729 -0.495361 -2.590161
H 0.174783 -3.023664 0.563177
H 2.401172 -1.692324 -1.181280
H 3.468917 -0.931215 0.026024
H 2.891419 -2.612577 0.268229
H 2.604602 -0.586151 2.462805
H 0.872922 -0.860535 2.851159
H 1.936890 -2.241422 2.466653
H -2.824437 2.311983 -0.112877
H -3.488696 0.812694 0.584021
H -3.170650 2.233391 1.633609
H -2.196044 -3.028070 -0.129559


