# generated using pymatgen data_Mg16Si8HO32 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.10296200 _cell_length_b 9.63574753 _cell_length_c 10.39727497 _cell_angle_alpha 90.16461189 _cell_angle_beta 90.64687078 _cell_angle_gamma 90.73067906 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg16Si8HO32 _chemical_formula_sum 'Mg16 Si8 H1 O32' _cell_volume 611.33693505 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Mg Mg0 1 0.00610300 0.99835200 0.99863500 1.0 Mg Mg1 1 0.00183100 0.24789200 0.50226900 1.0 Mg Mg2 1 0.50289200 0.99431700 0.98967400 1.0 Mg Mg3 1 0.50258600 0.24346300 0.51378300 1.0 Mg Mg4 1 0.22623300 0.50812700 0.27450900 1.0 Mg Mg5 1 0.78954600 0.23633600 0.21371200 1.0 Mg Mg6 1 0.75230700 0.00144900 0.72190100 1.0 Mg Mg7 1 0.25004300 0.25474300 0.78020600 1.0 Mg Mg8 1 0.99860700 0.50249000 0.99683900 1.0 Mg Mg9 1 0.99676700 0.74964700 0.50062500 1.0 Mg Mg10 1 0.49911200 0.50112700 0.99939700 1.0 Mg Mg11 1 0.49665700 0.74990900 0.49966500 1.0 Mg Mg12 1 0.25002700 0.99500700 0.28175600 1.0 Mg Mg13 1 0.74695200 0.74813500 0.22024400 1.0 Mg Mg14 1 0.74763100 0.50421000 0.72176500 1.0 Mg Mg15 1 0.25023600 0.75251500 0.77642400 1.0 Si Si16 1 0.25484500 0.21881500 0.09639500 1.0 Si Si17 1 0.74424300 0.46144000 0.40299400 1.0 Si Si18 1 0.75081100 0.28593900 0.90510300 1.0 Si Si19 1 0.24773200 0.03410300 0.59746300 1.0 Si Si20 1 0.25194900 0.71679500 0.09300100 1.0 Si Si21 1 0.75054400 0.96398200 0.40526200 1.0 Si Si22 1 0.75285900 0.78475400 0.90381800 1.0 Si Si23 1 0.24655300 0.53498000 0.59439200 1.0 H H24 1 0.47872900 0.29863200 0.27918700 1.0 O O25 1 0.24067900 0.38827000 0.09236300 1.0 O O26 1 0.75329400 0.13449200 0.40721600 1.0 O O27 1 0.75430700 0.11590300 0.90902500 1.0 O O28 1 0.24828300 0.36512900 0.59367900 1.0 O O29 1 0.25148300 0.10916000 0.45173700 1.0 O O30 1 0.75022700 0.35949700 0.05213200 1.0 O O31 1 0.74663300 0.38854200 0.54769400 1.0 O O32 1 0.26901600 0.14124900 0.95343500 1.0 O O33 1 0.04542100 0.13223300 0.16020900 1.0 O O34 1 0.94971900 0.38728300 0.32889100 1.0 O O35 1 0.53649400 0.36110900 0.83540500 1.0 O O36 1 0.46541400 0.10834900 0.66838700 1.0 O O37 1 0.96808700 0.36009300 0.83763700 1.0 O O38 1 0.03416600 0.10971000 0.66484700 1.0 O O39 1 0.46418600 0.17005400 0.18858000 1.0 O O40 1 0.50384300 0.38550600 0.33995300 1.0 O O41 1 0.25883100 0.88694000 0.09214100 1.0 O O42 1 0.74040500 0.63000800 0.40370200 1.0 O O43 1 0.75002700 0.61513500 0.90588200 1.0 O O44 1 0.24804000 0.86448800 0.59303100 1.0 O O45 1 0.24271700 0.60843600 0.44757700 1.0 O O46 1 0.75085600 0.85972100 0.04987400 1.0 O O47 1 0.74881300 0.88923600 0.55109100 1.0 O O48 1 0.25087000 0.64199600 0.94716600 1.0 O O49 1 0.03249100 0.64410300 0.16096600 1.0 O O50 1 0.96483000 0.88864500 0.33770700 1.0 O O51 1 0.53778600 0.85852000 0.83334300 1.0 O O52 1 0.46555700 0.61016500 0.66150800 1.0 O O53 1 0.96898200 0.86040200 0.83655200 1.0 O O54 1 0.03230900 0.60932800 0.66247600 1.0 O O55 1 0.46291900 0.63929500 0.16404300 1.0 O O56 1 0.53322000 0.88989400 0.33496900 1.0