%chk=000287529.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287529

0 1
O -1.418790 0.946303 0.518244
O -4.978793 -2.110754 1.285024
O -7.391159 -0.372456 -1.319628
C 3.951480 0.446229 -0.508270
C 5.355587 0.496109 0.109079
C 2.967453 1.334111 0.265426
C 6.339974 -0.391111 -0.664957
C 1.563931 1.280434 -0.351681
C 7.743998 -0.341486 -0.047821
C 0.579931 2.169024 0.418778
C 8.729704 -1.229122 -0.820833
C -0.830260 2.110409 -0.158440
C 10.129067 -1.183271 -0.211151
C -2.690372 0.574830 0.199068
C -3.123802 -0.557418 0.916448
C -3.513490 1.227638 -0.738308
C -4.414673 -1.025286 0.670100
C -5.276266 -0.396593 -0.266453
C -4.794844 0.729133 -0.955120
C -6.638822 -0.896884 -0.521029
C -4.191175 -2.836049 2.265003
H 3.584424 -0.598404 -0.523309
H 3.995114 0.765044 -1.567611
H 5.723601 1.540113 0.125273
H 5.313339 0.175223 1.167859
H 3.335351 2.378161 0.280340
H 2.926060 1.013404 1.324641
H 6.383073 -0.070838 -1.723838
H 5.972907 -1.435486 -0.681012
H 1.190823 0.235922 -0.354684
H 1.607030 1.590445 -1.413466
H 8.113220 0.701906 -0.031560
H 7.703118 -0.661488 1.011043
H 0.543979 1.851345 1.484824
H 0.932419 3.219090 0.427185
H 8.773332 -0.908997 -1.880277
H 8.363011 -2.274165 -0.835861
H -1.434660 2.994769 0.105495
H -0.855458 1.932990 -1.246224
H 10.825048 -1.819646 -0.769074
H 10.538518 -0.166736 -0.215958
H 10.128299 -1.530789 0.828196
H -2.449603 -1.022237 1.626398
H -3.172828 2.097859 -1.285320
H -5.462036 1.214228 -1.678810
H -6.940938 -1.783696 0.060192
H -4.890322 -3.625518 2.571136
H -3.299120 -3.258858 1.793415
H -3.940277 -2.182233 3.105531


%chk=000287529-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287529

0 1
O -1.402678 0.954864 0.472478
O -4.933043 -2.289984 1.131935
O -7.601459 -0.178322 -1.136935
C 3.916770 0.379760 -0.384649
C 5.387089 0.560155 0.055283
C 2.969457 1.454236 0.194712
C 6.336928 -0.511778 -0.525228
C 1.501418 1.277774 -0.252607
C 7.808222 -0.327022 -0.090219
C 0.567247 2.362413 0.327197
C 8.758967 -1.398221 -0.671855
C -0.891910 2.219706 -0.108161
C 10.226587 -1.205155 -0.232628
C -2.721772 0.590930 0.204872
C -3.131496 -0.631067 0.795845
C -3.619383 1.354501 -0.590687
C -4.445408 -1.096679 0.591150
C -5.370982 -0.345606 -0.207773
C -4.924452 0.871758 -0.780787
C -6.753355 -0.811665 -0.439801
C -4.026182 -3.098605 1.953193
H 3.562182 -0.625979 -0.076364
H 3.861098 0.401750 -1.493277
H 5.740330 1.566809 -0.252453
H 5.443747 0.537453 1.163913
H 3.329402 2.460161 -0.108680
H 3.020881 1.427542 1.303448
H 6.277724 -0.491506 -1.633806
H 5.986945 -1.518678 -0.214601
H 1.133311 0.280449 0.056110
H 1.449995 1.304176 -1.361556
H 8.159466 0.679552 -0.400596
H 7.869594 -0.348248 1.018269
H 0.612033 2.347012 1.433632
H 0.916459 3.365547 0.006623
H 8.697177 -1.376752 -1.779184
H 8.407938 -2.403622 -0.361160
H -1.508346 3.061658 0.266371
H -0.976979 2.171537 -1.213444
H 10.884857 -1.982639 -0.662333
H 10.611008 -0.219611 -0.557242
H 10.320313 -1.254000 0.868900
H -2.401845 -1.177005 1.398375
H -3.312219 2.297311 -1.049320
H -5.648500 1.427927 -1.387056
H -7.021081 -1.777535 0.042860
H -4.620521 -3.971868 2.258102
H -3.146244 -3.428466 1.368587
H -3.693186 -2.539770 2.848551


