%chk=000236550.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236550

0 1
O 1.905734 0.947733 -0.642716
O -2.503106 0.058601 0.760182
O -0.725340 3.067567 0.351219
O 2.187091 3.163632 -0.520208
O -1.935064 0.066213 -1.440225
C 1.500952 -1.211952 0.361785
C 0.857849 -0.070928 -0.442348
C -0.302460 0.656248 0.280184
C 2.748841 -1.725570 -0.386383
C 0.469120 -2.326533 0.629266
C -0.009179 2.144048 0.124128
C 1.464376 2.225885 -0.373436
C -1.641862 0.242815 -0.283520
C 3.627151 -2.611967 0.490081
C -0.148241 -2.931422 -0.627649
C -3.882024 -0.348432 0.457355
C -3.916012 -1.812992 0.082130
H 1.839335 -0.804246 1.348514
H 0.576460 -0.377359 -1.476912
H -0.291567 0.428898 1.385250
H 2.445630 -2.277037 -1.298058
H 3.342317 -0.854126 -0.742185
H 0.970713 -3.128445 1.211481
H -0.334423 -1.942568 1.289037
H 3.985860 -2.079003 1.378419
H 4.512450 -2.952052 -0.061426
H 3.093403 -3.506206 0.832077
H -0.777012 -2.216327 -1.172924
H 0.621898 -3.286805 -1.324726
H -0.780032 -3.792596 -0.379736
H -4.370140 -0.128471 1.425377
H -4.270887 0.310176 -0.339424
H -4.946519 -2.184759 0.016266
H -3.442723 -1.987627 -0.896446
H -3.385388 -2.433696 0.815770


%chk=000236550-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236550

0 1
O 1.959182 1.088248 -0.510871
O -2.585018 0.122840 0.743755
O -0.908143 3.061826 0.268749
O 2.019789 3.415628 -0.383189
O -1.858938 -0.103990 -1.467917
C 1.575323 -1.201172 0.342565
C 0.924867 -0.021088 -0.402833
C -0.299660 0.626921 0.293003
C 2.871765 -1.656330 -0.384362
C 0.549820 -2.354925 0.565026
C -0.084100 2.146566 0.114121
C 1.399523 2.348645 -0.285578
C -1.638878 0.166991 -0.264962
C 3.647074 -2.760339 0.365222
C 0.078457 -3.092640 -0.710574
C -3.986937 -0.238303 0.340761
C -4.177836 -1.756219 0.366698
H 1.869003 -0.822911 1.346849
H 0.668002 -0.285632 -1.444246
H -0.285911 0.434456 1.383498
H 2.621407 -2.003974 -1.406705
H 3.523831 -0.773011 -0.510204
H 1.014115 -3.086719 1.252494
H -0.334692 -1.963054 1.107632
H 3.881478 -2.449368 1.401067
H 4.604530 -2.974073 -0.143229
H 3.080930 -3.708248 0.416456
H -0.425272 -2.416552 -1.424989
H 0.921896 -3.575080 -1.235626
H -0.641219 -3.888253 -0.444263
H -4.605542 0.275065 1.092921
H -4.176772 0.180219 -0.662458
H -5.234359 -1.997641 0.147908
H -3.550204 -2.247332 -0.396000
H -3.930312 -2.169853 1.359478


