# generated using pymatgen data_Mg16Si8HO32 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.08826700 _cell_length_b 9.67200260 _cell_length_c 10.39206108 _cell_angle_alpha 89.86356361 _cell_angle_beta 89.84780191 _cell_angle_gamma 89.95801746 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg16Si8HO32 _chemical_formula_sum 'Mg16 Si8 H1 O32' _cell_volume 611.94009143 _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 0.00030600 0.00128500 0.00073200 1.0 Mg Mg1 1 0.00341100 0.24320300 0.49820200 1.0 Mg Mg2 1 0.49904700 0.00095500 0.00057800 1.0 Mg Mg3 1 0.49113400 0.23824700 0.48881900 1.0 Mg Mg4 1 0.24878200 0.49721800 0.27647800 1.0 Mg Mg5 1 0.74974000 0.24189900 0.21908500 1.0 Mg Mg6 1 0.74984700 0.00475300 0.72270000 1.0 Mg Mg7 1 0.25291800 0.25355100 0.77767500 1.0 Mg Mg8 1 0.00128400 0.49956200 0.00329400 1.0 Mg Mg9 1 0.00109400 0.75230200 0.49885900 1.0 Mg Mg10 1 0.49924300 0.49980400 0.00166700 1.0 Mg Mg11 1 0.49949200 0.75113800 0.49879100 1.0 Mg Mg12 1 0.24853800 0.99298900 0.27597900 1.0 Mg Mg13 1 0.74865600 0.74807800 0.22130400 1.0 Mg Mg14 1 0.77109500 0.51545400 0.74154900 1.0 Mg Mg15 1 0.24638200 0.75647200 0.78083900 1.0 Si Si16 1 0.25025100 0.21372700 0.09533100 1.0 Si Si17 1 0.74781900 0.46827700 0.39440500 1.0 Si Si18 1 0.75079000 0.28649200 0.90462300 1.0 Si Si19 1 0.24918200 0.03312500 0.59699100 1.0 Si Si20 1 0.24910500 0.71368200 0.09548700 1.0 Si Si21 1 0.75025000 0.96293300 0.40517200 1.0 Si Si22 1 0.74957700 0.78945600 0.90724200 1.0 Si Si23 1 0.24615200 0.53471600 0.59156500 1.0 H H24 1 0.59320200 0.45037800 0.58812000 1.0 O O25 1 0.24947400 0.38378500 0.09398500 1.0 O O26 1 0.75121300 0.13397600 0.40670700 1.0 O O27 1 0.75023000 0.11704200 0.90651400 1.0 O O28 1 0.24796800 0.36422900 0.58805700 1.0 O O29 1 0.24508200 0.10251100 0.44791000 1.0 O O30 1 0.74996900 0.35959600 0.05148200 1.0 O O31 1 0.72953200 0.40104700 0.55348600 1.0 O O32 1 0.25107000 0.14087100 0.94874100 1.0 O O33 1 0.03376300 0.13923500 0.16375600 1.0 O O34 1 0.96793600 0.38679300 0.34455900 1.0 O O35 1 0.53720100 0.36324300 0.83513600 1.0 O O36 1 0.46642300 0.11067100 0.66087300 1.0 O O37 1 0.96834900 0.36311800 0.83698200 1.0 O O38 1 0.03403000 0.11127900 0.66395700 1.0 O O39 1 0.46533200 0.13861200 0.16435200 1.0 O O40 1 0.53305100 0.38706300 0.33491700 1.0 O O41 1 0.24907000 0.88331700 0.09335600 1.0 O O42 1 0.74870800 0.63591500 0.40401300 1.0 O O43 1 0.75143100 0.61918200 0.91205200 1.0 O O44 1 0.25136300 0.86324800 0.59666300 1.0 O O45 1 0.24619100 0.61135200 0.44688100 1.0 O O46 1 0.74859900 0.86265600 0.05285500 1.0 O O47 1 0.75132500 0.89027900 0.55201800 1.0 O O48 1 0.25000900 0.64023400 0.94886400 1.0 O O49 1 0.03258400 0.63802700 0.16410300 1.0 O O50 1 0.96496600 0.88825800 0.33576100 1.0 O O51 1 0.53334000 0.86023000 0.83634100 1.0 O O52 1 0.47816700 0.59714300 0.65497100 1.0 O O53 1 0.96581000 0.86260100 0.83788600 1.0 O O54 1 0.03962300 0.61249100 0.66568300 1.0 O O55 1 0.46492700 0.63882500 0.16446600 1.0 O O56 1 0.53313800 0.88970400 0.33760500 1.0