%chk=000271302.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271302

0 1
O 5.291087 -0.007134 0.409189
O 2.110926 -3.030300 -1.387130
O 3.647020 2.647118 -0.649417
O -0.415594 -2.783716 -0.759747
O 3.354463 0.892789 -2.056822
O -1.656304 2.764348 1.003655
O -2.840631 -2.252928 -0.579338
O -5.353329 -1.719138 -0.574681
C 3.969830 -0.486258 0.694540
C 2.955588 0.664119 0.373347
C 3.777294 -1.629811 -0.306584
C 2.366666 -2.206672 -0.228439
C 1.540793 0.152698 0.247807
C 1.276058 -1.168145 -0.106801
C 3.851211 -0.886104 2.177432
C 0.481783 1.056413 0.475773
C -0.079046 -1.560881 -0.314895
C 3.334605 1.339611 -0.937643
C -0.836793 0.642914 0.334813
C -1.149963 -0.669401 -0.067521
C 4.853830 -1.964242 2.570121
C -1.927495 1.647681 0.614819
C -2.548758 -1.106338 -0.246014
C -3.616871 -0.118572 -0.012048
C -3.342901 1.208311 0.395642
C -4.964844 -0.488690 -0.196288
C -4.366534 2.117880 0.602668
C 4.052153 3.486390 -1.766508
C -6.022635 0.442767 0.013093
C -5.714472 1.726510 0.406654
H 3.009887 1.432465 1.192666
H 4.538233 -2.419565 -0.143798
H 3.994697 -1.248929 -1.334275
H 2.279175 -2.956141 0.600092
H 2.819015 -1.231086 2.392380
H 3.997178 0.005644 2.819829
H 0.689275 2.092685 0.763511
H 5.613404 0.608337 1.097560
H 4.586409 -2.943803 2.155681
H 5.863954 -1.725695 2.208222
H 4.909650 -2.076725 3.659502
H 2.213243 -2.507663 -2.219210
H 0.398519 -3.348920 -1.048040
H -4.136687 3.138574 0.918562
H 4.119641 4.478233 -1.307118
H 3.292752 3.450578 -2.554563
H 5.020124 3.139517 -2.141451
H -7.048023 0.108680 -0.145216
H -6.507697 2.458602 0.573304
H -4.542088 -2.369609 -0.714516


%chk=000271302-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271302

0 1
O 5.329216 0.075475 0.509452
O 2.201809 -2.952884 -1.588058
O 3.964919 2.626741 -0.709475
O -0.305500 -2.845548 -0.866041
O 3.245158 0.918076 -2.119847
O -1.714400 2.787402 1.046643
O -2.930040 -2.328382 -0.654072
O -5.382827 -1.838664 -0.542489
C 3.946211 -0.406532 0.718560
C 2.931884 0.732487 0.342631
C 3.804369 -1.564210 -0.287342
C 2.382650 -2.140504 -0.336591
C 1.505886 0.211299 0.207921
C 1.260807 -1.115760 -0.204697
C 3.742786 -0.815360 2.203461
C 0.419611 1.072758 0.470482
C -0.089206 -1.565898 -0.406258
C 3.374216 1.394063 -0.969214
C -0.908151 0.628165 0.328692
C -1.196983 -0.704455 -0.117869
C 4.646071 -1.976179 2.667876
C -1.997878 1.611686 0.647086
C -2.605576 -1.132298 -0.269307
C -3.680247 -0.166081 0.029960
C -3.405911 1.163421 0.475460
C -5.051396 -0.577139 -0.123723
C -4.457393 2.059370 0.757055
C 4.491639 3.351824 -1.895817
C -6.101837 0.338432 0.162419
C -5.801910 1.640550 0.597351
H 2.967178 1.512948 1.125153
H 4.523731 -2.362289 -0.043430
H 4.074123 -1.170644 -1.283656
H 2.247310 -2.910854 0.446939
H 2.678672 -1.067431 2.377603
H 3.946173 0.081076 2.826527
H 0.580333 2.105386 0.797509
H 5.479846 0.875697 1.077128
H 4.359772 -2.934604 2.198246
H 5.702013 -1.775322 2.415404
H 4.570297 -2.109798 3.761686
H 2.410058 -2.376180 -2.369096
H 0.564834 -3.196373 -1.266349
H -4.206635 3.068470 1.096057
H 4.873911 4.301207 -1.496718
H 3.682905 3.520793 -2.625550
H 5.295135 2.762441 -2.367650
H -7.132453 -0.004605 0.033661
H -6.618786 2.336670 0.814934
H -4.478593 -2.342043 -0.689847


