# generated using pymatgen data_YMg4(SiO3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.75016881 _cell_length_b 11.75016881 _cell_length_c 11.75016881 _cell_angle_alpha 102.96409529 _cell_angle_beta 123.45756056 _cell_angle_gamma 102.96409529 _symmetry_Int_Tables_number 1 _chemical_formula_structural YMg4(SiO3)4 _chemical_formula_sum 'Y4 Mg16 Si16 O48' _cell_volume 1192.03014131 _cell_formula_units_Z 4 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 Y Y0 1 0.50000000 0.00000000 0.50000000 1.0 Y Y1 1 0.75000000 0.50000000 0.25000000 1.0 Y Y2 1 0.00000000 0.00000000 0.00000000 1.0 Y Y3 1 0.25000000 0.50000000 0.75000000 1.0 Mg Mg4 1 0.20176400 0.44356700 0.13041900 1.0 Mg Mg5 1 0.68685100 0.55643300 0.75819600 1.0 Mg Mg6 1 0.00819600 0.57134500 0.95176300 1.0 Mg Mg7 1 0.04823700 0.05643300 0.61958100 1.0 Mg Mg8 1 0.38041900 0.42865500 0.43685100 1.0 Mg Mg9 1 0.56314900 0.94356700 0.99180400 1.0 Mg Mg10 1 0.24180400 0.92865500 0.79823700 1.0 Mg Mg11 1 0.86958100 0.07134500 0.31314900 1.0 Mg Mg12 1 0.37955900 0.24585100 0.60133200 1.0 Mg Mg13 1 0.35548000 0.75414900 0.13370800 1.0 Mg Mg14 1 0.38370800 0.27822800 0.12955900 1.0 Mg Mg15 1 0.87044100 0.25414900 0.14866800 1.0 Mg Mg16 1 0.85133200 0.72177200 0.10548000 1.0 Mg Mg17 1 0.89452000 0.74585100 0.61629200 1.0 Mg Mg18 1 0.86629200 0.22177200 0.62044100 1.0 Mg Mg19 1 0.39866800 0.77822800 0.64452000 1.0 Si Si20 1 0.62500000 0.25000000 0.87500000 1.0 Si Si21 1 0.62500000 0.75000000 0.37500000 1.0 Si Si22 1 0.62500000 0.25000000 0.37500000 1.0 Si Si23 1 0.12500000 0.75000000 0.37500000 1.0 Si Si24 1 0.12500000 0.25000000 0.37500000 1.0 Si Si25 1 0.12500000 0.75000000 0.87500000 1.0 Si Si26 1 0.12500000 0.25000000 0.87500000 1.0 Si Si27 1 0.62500000 0.75000000 0.87500000 1.0 Si Si28 1 0.25421800 0.65696700 0.32207200 1.0 Si Si29 1 0.66510500 0.34303300 0.59725000 1.0 Si Si30 1 0.84725000 0.43214500 0.00421800 1.0 Si Si31 1 0.99578200 0.84303300 0.42792800 1.0 Si Si32 1 0.57207200 0.56785500 0.41510500 1.0 Si Si33 1 0.58489500 0.15696700 0.15275000 1.0 Si Si34 1 0.40275000 0.06785500 0.74578200 1.0 Si Si35 1 0.67792800 0.93214500 0.33489500 1.0 O O36 1 0.29478900 0.05925900 0.32314100 1.0 O O37 1 0.26388200 0.94074100 0.23553000 1.0 O O38 1 0.48553000 0.47164800 0.04478900 1.0 O O39 1 0.95521100 0.44074100 0.42685900 1.0 O O40 1 0.57314100 0.52835200 0.01388200 1.0 O O41 1 0.98611800 0.55925900 0.51447000 1.0 O O42 1 0.76447000 0.02835200 0.70521100 1.0 O O43 1 0.67685900 0.97164800 0.73611800 1.0 O O44 1 0.01910900 0.16134200 0.18356000 1.0 O O45 1 0.02221800 0.83865800 0.85776600 1.0 O O46 1 0.10776600 0.33554800 0.76910900 1.0 O O47 1 0.23089100 0.33865800 0.56644000 1.0 O O48 1 0.43356000 0.66445200 0.77221800 1.0 O O49 1 0.22778200 0.66134200 0.89223400 1.0 O O50 1 0.14223400 0.16445200 0.98089100 1.0 O O51 1 0.81644000 0.83554800 0.97778200 1.0 O O52 1 0.41152900 0.43275700 0.27363900 1.0 O O53 1 0.84088200 0.56724300 0.97877200 1.0 O O54 1 0.22877200 0.63789000 0.16152900 1.0 O O55 1 0.83847100 0.06724300 0.47636100 1.0 O O56 1 0.52363900 0.36211000 0.59088200 1.0 O O57 1 0.40911800 0.93275700 0.77122800 1.0 O O58 1 0.02122800 0.86211000 0.58847100 1.0 O O59 1 0.72636100 0.13789000 0.15911800 1.0 O O60 1 0.25284200 0.51994900 0.33439700 1.0 O O61 1 0.81444800 0.48005100 0.73289300 1.0 O O62 1 0.98289300 0.41844500 0.00284200 1.0 O O63 1 0.99715800 0.98005100 0.41560300 1.0 O O64 1 0.58439700 0.58155500 0.56444800 1.0 O O65 1 0.43555200 0.01994900 0.01710700 1.0 O O66 1 0.26710700 0.08155500 0.74715800 1.0 O O67 1 0.66560300 0.91844500 0.18555200 1.0 O O68 1 0.51478500 0.32148000 0.81841000 1.0 O O69 1 0.49693000 0.67852000 0.19330500 1.0 O O70 1 0.44330500 0.19637500 0.26478500 1.0 O O71 1 0.73521500 0.17852000 0.93159000 1.0 O O72 1 0.06841000 0.80362500 0.24693000 1.0 O O73 1 0.75307000 0.82148000 0.55669500 1.0 O O74 1 0.80669500 0.30362500 0.48521500 1.0 O O75 1 0.18159000 0.69637500 0.50307000 1.0 O O76 1 0.68366300 0.21097500 0.61753400 1.0 O O77 1 0.40655900 0.78902500 0.47268800 1.0 O O78 1 0.72268800 0.56612900 0.43366300 1.0 O O79 1 0.56633700 0.28902500 0.13246600 1.0 O O80 1 0.86753400 0.43387100 0.15655900 1.0 O O81 1 0.84344100 0.71097500 0.27731200 1.0 O O82 1 0.52731200 0.93387100 0.31633700 1.0 O O83 1 0.38246600 0.06612900 0.59344100 1.0