%chk=000227872.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227872

0 1
O -1.918585 0.754677 -0.935155
O -1.527833 -1.124444 0.252835
O 0.976395 0.764623 1.813064
C -1.089574 0.246502 0.107196
C 0.326421 0.366353 -0.393317
C 1.384658 0.659671 0.497862
C 0.626007 0.204016 -1.747460
C -3.351584 0.592685 -0.704263
C -0.670049 -1.968892 1.062356
C 2.704114 0.796316 0.053755
C 1.942838 0.334953 -2.208454
C 2.969572 0.631414 -1.311015
C -3.988501 1.389095 -1.827845
C -1.580362 -3.081858 1.551615
C 1.956477 1.172281 2.797974
H -1.280944 0.774668 1.064719
H -0.191000 -0.018825 -2.441643
H -3.577408 -0.487533 -0.755977
H -3.600825 0.984898 0.295330
H 0.134621 -2.338180 0.401625
H -0.234798 -1.378738 1.889101
H 3.512732 1.024478 0.738286
H 2.159396 0.207780 -3.266112
H 3.993351 0.736053 -1.671138
H -5.080840 1.331473 -1.789649
H -3.695194 2.446095 -1.781389
H -3.659136 1.016118 -2.807432
H -1.018120 -3.858004 2.079697
H -2.355939 -2.696462 2.224683
H -2.104107 -3.552263 0.707363
H 2.356098 2.160213 2.551007
H 2.746347 0.420221 2.879047
H 1.351672 1.210617 3.713435


%chk=000227872-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227872

0 1
O -1.922805 0.758843 -0.985935
O -1.473250 -1.279533 0.085865
O 0.966644 0.940839 1.786610
C -1.075211 0.153131 0.003639
C 0.363639 0.311230 -0.450716
C 1.384398 0.697447 0.461077
C 0.713930 0.045431 -1.792600
C -3.354500 0.774266 -0.607582
C -0.879376 -1.982654 1.236199
C 2.728526 0.818548 0.030384
C 2.050523 0.161327 -2.233947
C 3.053858 0.548471 -1.317966
C -4.096430 1.542241 -1.699692
C -1.520535 -3.369096 1.301566
C 1.974675 1.397897 2.744139
H -1.235767 0.606581 1.007685
H -0.085721 -0.241035 -2.482238
H -3.715078 -0.267048 -0.517637
H -3.462110 1.272191 0.381618
H 0.220200 -2.060475 1.102762
H -1.067161 -1.406188 2.168760
H 3.517996 1.117677 0.726054
H 2.305931 -0.044442 -3.278567
H 4.094776 0.642648 -1.647766
H -5.177549 1.584840 -1.472384
H -3.711990 2.573416 -1.783370
H -3.964458 1.044069 -2.675752
H -1.095789 -3.951095 2.140255
H -2.611945 -3.287847 1.446799
H -1.337770 -3.921610 0.363632
H 2.433821 2.352175 2.420569
H 2.766405 0.637621 2.892022
H 1.428024 1.550135 3.686620


