%chk=000104626.chk %nprocshared=4 %mem=7GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000104626 0 1 Si -0.3407000 -0.1894000 0.1239000 O -1.312700 -1.435800 -0.4215000 O -0.3720000 1.098200 -0.9439000 C 1.434600 -0.8388000 0.1408000 C -2.713400 -1.232300 -0.5383000 C 0.4507000 2.233100 -0.7128000 C -0.7920000 0.3498000 1.856500 C -3.322700 -2.537400 -1.047600 C -2.957800 -0.1013000 -1.536900 C 0.1899000 3.223500 -1.846400 C 1.911300 1.783200 -0.7198000 C 2.136400 -0.8408000 1.331000 C 1.992500 -1.297400 -1.037200 C 3.446600 -1.319300 1.343700 C 3.302600 -1.776000 -1.024400 C -3.270700 -0.8891000 0.7820000 C 9.9299997E-02 2.837400 0.5846000 C 4.029600 -1.786900 0.1660000 C -3.723500 -0.6093000 1.858400 C -0.1878000 3.328500 1.642100 H 3.0300001E-02 0.8495000 2.373400 H -1.652400 1.022400 1.877000 H -1.018400 -0.5271000 2.472600 H -2.895300 -2.814400 -2.018400 H -3.103000 -3.366500 -0.3639000 H -4.410800 -2.467100 -1.154700 H -2.332500 -0.2028000 -2.431700 H -2.805100 0.8986000 -1.116100 H -4.004300 -0.1081000 -1.868900 H 0.4289000 2.775500 -2.817900 H -0.8701000 3.503100 -1.886400 H 0.7768000 4.141800 -1.733000 H 2.151600 1.130300 -1.560100 H 2.287300 1.432100 0.2396000 H 2.539000 2.672900 -0.8862000 H 1.721900 -0.4985000 2.272200 H 1.442900 -1.302400 -1.975000 H 4.012400 -1.330400 2.270700 H 3.756500 -2.141000 -1.941000 H 5.049400 -2.160200 0.1760000 H -4.124100 -0.3606000 2.813200 H -0.4428000 3.763200 2.580100 %chk=000104626-Freq.chk %nprocshared=4 %mem=7GB #p freq=noraman PBEPBE/SDD 000104626 0 1 Si -0.308770 -0.145256 0.540353 O -1.253940 -1.305520 -0.330389 O -0.495439 1.336447 -0.379433 C 1.433670 -0.898236 0.454819 C -2.622773 -1.245821 -0.882442 C 0.373119 2.526371 -0.489700 C -0.906839 0.136554 2.312042 C -3.018472 -2.719222 -1.134781 C -2.600602 -0.431167 -2.201752 C -0.542190 3.648801 -1.032830 C 1.532519 2.224602 -1.474980 C 2.468687 -0.471566 1.331682 C 1.726207 -1.913528 -0.496220 C 3.761468 -1.039291 1.257106 C 3.017252 -2.483101 -0.572712 C -3.570637 -0.626277 0.082729 C 0.915172 2.919244 0.840121 C 4.038738 -2.045547 0.302757 C -4.388095 -0.129514 0.861174 C 1.359561 3.265255 1.937894 H -0.228705 0.827019 2.843849 H -1.917546 0.576312 2.307014 H -0.942034 -0.820633 2.861803 H -2.286028 -3.171720 -1.825157 H -3.008785 -3.283878 -0.188389 H -4.025760 -2.780344 -1.582531 H -1.901094 -0.913318 -2.906987 H -2.255158 0.595911 -2.003192 H -3.607430 -0.401623 -2.655192 H -0.957987 3.329540 -2.003900 H -1.374710 3.830828 -0.334145 H 0.026672 4.584824 -1.171180 H 1.101747 1.917565 -2.443727 H 2.170420 1.409249 -1.095943 H 2.157578 3.122803 -1.625978 H 2.273330 0.312112 2.074135 H 0.928247 -2.261349 -1.161415 H 4.547812 -0.698131 1.940208 H 3.225115 -3.267760 -1.309384 H 5.040448 -2.487125 0.244577 H -5.094265 0.310645 1.541120 H 1.747899 3.576046 2.890676