%chk=000251111.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251111

0 1
O 4.848158 -0.844512 -0.351198
O 6.805887 0.243653 0.032137
O -5.941122 -0.691413 -0.035198
O -6.539365 1.201356 -1.174264
C 2.535277 -0.314721 0.080339
C 1.798717 1.058288 0.221435
C 0.327579 0.918824 -0.187047
C 4.012966 0.139106 0.364512
C 2.697057 2.047832 -0.541056
C 1.897699 -1.297644 1.076322
C -0.345508 -0.069698 0.810590
C 4.133633 1.533220 -0.304709
C 0.387602 -1.430578 0.807107
C -0.426647 2.255311 -0.155002
C 2.465823 -0.900061 -1.338789
C 4.439009 0.126884 1.822463
C -1.827326 -0.199410 0.527081
C -1.856129 2.060122 -0.670832
C -2.530236 0.822592 -0.142596
C -2.534417 -1.323034 0.991101
C -3.914533 0.703906 -0.360259
C 6.206803 -0.696839 -0.436181
C -3.904447 -1.459679 0.786513
C -4.571404 -0.430663 0.104216
C 6.765740 -1.858565 -1.188511
C -6.844285 0.152256 -0.672635
C -8.177828 -0.505510 -0.591158
H 1.821234 1.358008 1.301044
H 0.261814 0.497252 -1.219047
H 2.571257 3.078404 -0.174507
H 2.454006 2.066914 -1.616685
H 2.060096 -0.962441 2.117151
H 2.382282 -2.288479 0.997234
H -0.256595 0.364345 1.842113
H 4.691708 1.456019 -1.253432
H 4.718705 2.227563 0.321557
H 0.223518 -1.934460 -0.165901
H -0.056755 -2.096119 1.572385
H 0.095229 3.009416 -0.772831
H -0.444042 2.665357 0.872671
H 2.881004 -0.213272 -2.083690
H 3.049295 -1.827705 -1.400088
H 1.436195 -1.128617 -1.634445
H 3.779603 0.741749 2.444233
H 4.447264 -0.889606 2.232212
H 5.460375 0.526171 1.936561
H -1.849670 2.006962 -1.782004
H -2.464260 2.955612 -0.423061
H -2.003075 -2.111419 1.528383
H -4.461334 1.491548 -0.884551
H -4.453249 -2.328045 1.139716
H 5.983345 -2.554194 -1.528922
H 7.470175 -2.424056 -0.559487
H 7.323927 -1.515587 -2.072972
H -8.583946 -0.687121 -1.599275
H -8.896987 0.138373 -0.059686
H -8.141923 -1.473896 -0.064558


%chk=000251111-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251111

0 1
O 4.981983 -0.912001 -0.236488
O 6.900639 0.414121 0.005469
O -6.077630 -0.681197 0.035164
O -6.744760 1.342059 -0.976535
C 2.582250 -0.334353 -0.017104
C 1.813429 1.022173 0.108153
C 0.321761 0.892948 -0.248811
C 4.045912 0.149163 0.307999
C 2.699089 2.029334 -0.670900
C 1.942332 -1.354010 0.955505
C -0.334479 -0.147955 0.712585
C 4.163069 1.505773 -0.473418
C 0.418343 -1.510814 0.694515
C -0.449187 2.226921 -0.150038
C 2.545908 -0.896548 -1.466833
C 4.364142 0.296628 1.808585
C -1.848875 -0.261680 0.472369
C -1.887868 2.052645 -0.674929
C -2.577584 0.794841 -0.148648
C -2.574281 -1.401355 0.912332
C -3.983200 0.699535 -0.316219
C 6.351329 -0.666664 -0.313127
C -3.967266 -1.506530 0.750949
C -4.666578 -0.447719 0.134329
C 7.069847 -1.901258 -0.824103
C -7.017511 0.218420 -0.505276
C -8.394673 -0.403313 -0.415710
H 1.844704 1.314418 1.182231
H 0.223419 0.528675 -1.293982
H 2.581358 3.061557 -0.297163
H 2.424435 2.040143 -1.742783
H 2.081067 -1.011048 2.000157
H 2.438194 -2.340728 0.869300
H -0.200391 0.268751 1.739682
H 4.660500 1.334550 -1.443832
H 4.795727 2.216524 0.081592
H 0.237444 -2.018641 -0.272542
H 0.008301 -2.177917 1.476178
H 0.063091 3.016279 -0.731932
H -0.464733 2.561456 0.908002
H 2.984910 -0.194551 -2.196676
H 3.125873 -1.832742 -1.517802
H 1.515802 -1.114122 -1.792272
H 3.642097 0.973044 2.298756
H 4.326591 -0.680678 2.320184
H 5.371799 0.724614 1.936354
H -1.862044 2.000482 -1.783619
H -2.501921 2.939683 -0.427716
H -2.046018 -2.228760 1.395594
H -4.532065 1.515979 -0.788926
H -4.520150 -2.386057 1.093656
H 6.541058 -2.328649 -1.692084
H 7.088534 -2.674086 -0.034527
H 8.103418 -1.641807 -1.096293
H -9.136299 0.281590 -0.850877
H -8.649944 -0.609850 0.638246
H -8.413003 -1.367574 -0.952222


