%chk=000114632.chk %nprocshared=4 %mem=3GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000114632 0 1 Si 2.178300 -0.2094000 -7.1000002E-02 O 0.9664000 0.2547000 0.9865000 O -2.987500 0.8600000 -0.4602000 C 2.471100 1.096600 -1.394800 C 1.764100 -1.839200 -0.9172000 C 3.793100 -0.4449000 0.8741000 C -0.2855000 0.4968000 0.5286000 C -0.5537000 1.910100 0.1102000 C -1.219400 -0.4638000 0.4530000 C -2.605700 -0.2323000 -4.8300002E-02 C -3.521300 -1.428500 -6.0800001E-02 H 1.588300 1.212000 -2.030100 H 2.697900 2.063900 -0.9370000 H 3.314000 0.8121000 -2.031600 H 1.567800 -2.618100 -0.1747000 H 0.8792000 -1.734800 -1.551600 H 2.597600 -2.165900 -1.546100 H 4.088500 0.4876000 1.363800 H 3.677800 -1.216600 1.640900 H 4.595000 -0.7486000 0.1950000 H -0.7500000 1.979900 -0.9644000 H 0.3124000 2.549200 0.3183000 H -1.385200 2.344200 0.6748000 H -0.9828000 -1.474900 0.7712000 H -3.227100 -2.157600 0.6991000 H -4.540600 -1.103400 0.1668000 H -3.493400 -1.896100 -1.048100 %chk=000114632-Freq.chk %nprocshared=4 %mem=3GB #p freq=noraman PBEPBE/SDD 000114632 0 1 Si 2.241691 -0.350186 -0.306417 O 1.109537 0.637905 0.658993 O -3.244890 0.809779 0.588142 C 2.030172 0.084447 -2.147748 C 1.925491 -2.192075 0.059557 C 3.909987 0.233706 0.374724 C -0.264982 0.731231 0.686525 C -0.744635 1.750189 1.688892 C -1.082771 -0.035553 -0.128306 C -2.550492 0.022453 -0.137639 C -3.243817 -0.948108 -1.101830 H 1.034932 -0.196242 -2.533764 H 2.162020 1.169786 -2.306412 H 2.791266 -0.441774 -2.753990 H 1.975598 -2.382882 1.146553 H 0.937428 -2.528625 -0.299130 H 2.696336 -2.816307 -0.430212 H 4.029208 1.321328 0.225710 H 3.981019 0.030398 1.457749 H 4.750853 -0.277751 -0.128263 H -1.179630 2.624839 1.171904 H 0.101368 2.073501 2.315677 H -1.563663 1.340352 2.301842 H -0.622538 -0.751261 -0.821077 H -2.977263 -1.995613 -0.864289 H -4.335135 -0.825206 -1.025887 H -2.927789 -0.755334 -2.144903