# generated using pymatgen data_TiZn(Si2O5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.44418900 _cell_length_b 7.44418900 _cell_length_c 15.72651200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TiZn(Si2O5)2 _chemical_formula_sum 'Ti4 Zn4 Si16 O40' _cell_volume 871.49960059 _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 Ti Ti0 1 0.50000000 0.00000000 0.57486500 1.0 Ti Ti1 1 0.00000000 0.50000000 0.92513500 1.0 Ti Ti2 1 0.00000000 0.50000000 0.42513500 1.0 Ti Ti3 1 0.50000000 0.00000000 0.07486500 1.0 Zn Zn4 1 0.50000000 0.50000000 0.50000000 1.0 Zn Zn5 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn6 1 0.00000000 0.00000000 0.00000000 1.0 Zn Zn7 1 0.50000000 0.50000000 0.00000000 1.0 Si Si8 1 0.16945200 0.25161500 0.65032800 1.0 Si Si9 1 0.83054800 0.74838500 0.65032800 1.0 Si Si10 1 0.25161500 0.16945200 0.84967200 1.0 Si Si11 1 0.75161500 0.33054800 0.65032800 1.0 Si Si12 1 0.24838500 0.66945200 0.65032800 1.0 Si Si13 1 0.33054800 0.75161500 0.84967200 1.0 Si Si14 1 0.66945200 0.24838500 0.84967200 1.0 Si Si15 1 0.74838500 0.83054800 0.84967200 1.0 Si Si16 1 0.33054800 0.24838500 0.34967200 1.0 Si Si17 1 0.66945200 0.75161500 0.34967200 1.0 Si Si18 1 0.24838500 0.33054800 0.15032800 1.0 Si Si19 1 0.74838500 0.16945200 0.34967200 1.0 Si Si20 1 0.25161500 0.83054800 0.34967200 1.0 Si Si21 1 0.16945200 0.74838500 0.15032800 1.0 Si Si22 1 0.83054800 0.25161500 0.15032800 1.0 Si Si23 1 0.75161500 0.66945200 0.15032800 1.0 O O24 1 0.25935300 0.10432600 0.58737400 1.0 O O25 1 0.74064700 0.89567400 0.58737400 1.0 O O26 1 0.10432600 0.25935300 0.91262600 1.0 O O27 1 0.60432600 0.24064700 0.58737400 1.0 O O28 1 0.39567400 0.75935300 0.58737400 1.0 O O29 1 0.24064700 0.60432600 0.91262600 1.0 O O30 1 0.75935300 0.39567400 0.91262600 1.0 O O31 1 0.89567400 0.74064700 0.91262600 1.0 O O32 1 0.24064700 0.39567400 0.41262600 1.0 O O33 1 0.75935300 0.60432600 0.41262600 1.0 O O34 1 0.39567400 0.24064700 0.08737400 1.0 O O35 1 0.89567400 0.25935300 0.41262600 1.0 O O36 1 0.10432600 0.74064700 0.41262600 1.0 O O37 1 0.25935300 0.89567400 0.08737400 1.0 O O38 1 0.74064700 0.10432600 0.08737400 1.0 O O39 1 0.25220400 0.04688700 0.36888400 1.0 O O40 1 0.60432600 0.75935300 0.08737400 1.0 O O41 1 0.75220400 0.54688700 0.63111600 1.0 O O42 1 0.45311300 0.24779600 0.86888400 1.0 O O43 1 0.95311300 0.25220400 0.63111600 1.0 O O44 1 0.04688700 0.74779600 0.63111600 1.0 O O45 1 0.25220400 0.95311300 0.86888400 1.0 O O46 1 0.74779600 0.04688700 0.86888400 1.0 O O47 1 0.54688700 0.75220400 0.86888400 1.0 O O48 1 0.70296700 0.70296700 0.25000000 1.0 O O49 1 0.79703300 0.20296700 0.25000000 1.0 O O50 1 0.20296700 0.79703300 0.25000000 1.0 O O51 1 0.29703300 0.29703300 0.25000000 1.0 O O52 1 0.79703300 0.79703300 0.75000000 1.0 O O53 1 0.70296700 0.29703300 0.75000000 1.0 O O54 1 0.29703300 0.70296700 0.75000000 1.0 O O55 1 0.20296700 0.20296700 0.75000000 1.0 O O56 1 0.95311300 0.74779600 0.13111600 1.0 O O57 1 0.75220400 0.45311300 0.13111600 1.0 O O58 1 0.24779600 0.54688700 0.13111600 1.0 O O59 1 0.45311300 0.75220400 0.36888400 1.0 O O60 1 0.54688700 0.24779600 0.36888400 1.0 O O61 1 0.04688700 0.25220400 0.13111600 1.0 O O62 1 0.74779600 0.95311300 0.36888400 1.0 O O63 1 0.24779600 0.45311300 0.63111600 1.0