# generated using pymatgen data_Ta5Zn7O18 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.83756317 _cell_length_b 8.83756317 _cell_length_c 10.58746648 _cell_angle_alpha 87.74635980 _cell_angle_beta 87.74635980 _cell_angle_gamma 63.54046134 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta5Zn7O18 _chemical_formula_sum 'Ta10 Zn14 O36' _cell_volume 739.49630256 _cell_formula_units_Z 2 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 Ta Ta0 1 0.69980200 0.00124700 0.26519900 1.0 Ta Ta1 1 0.30019800 0.99875300 0.73480100 1.0 Ta Ta2 1 0.99875300 0.30019800 0.23480100 1.0 Ta Ta3 1 0.00124700 0.69980200 0.76519900 1.0 Ta Ta4 1 0.66334700 0.66175300 0.20446000 1.0 Ta Ta5 1 0.33665300 0.33824700 0.79554000 1.0 Ta Ta6 1 0.33824700 0.33665300 0.29554000 1.0 Ta Ta7 1 0.66175300 0.66334700 0.70446000 1.0 Ta Ta8 1 0.00000000 0.00000000 0.00000000 1.0 Ta Ta9 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn10 1 0.43428500 0.88966800 0.44958700 1.0 Zn Zn11 1 0.56571500 0.11033200 0.55041300 1.0 Zn Zn12 1 0.11033200 0.56571500 0.05041300 1.0 Zn Zn13 1 0.88966800 0.43428500 0.94958700 1.0 Zn Zn14 1 0.34845200 0.03598100 0.06437500 1.0 Zn Zn15 1 0.65154800 0.96401900 0.93562500 1.0 Zn Zn16 1 0.96401900 0.65154800 0.43562500 1.0 Zn Zn17 1 0.03598100 0.34845200 0.56437500 1.0 Zn Zn18 1 0.22986500 0.77013500 0.25000000 1.0 Zn Zn19 1 0.77013500 0.22986500 0.75000000 1.0 Zn Zn20 1 0.62003500 0.32903500 0.03431900 1.0 Zn Zn21 1 0.37996500 0.67096500 0.96568100 1.0 Zn Zn22 1 0.67096500 0.37996500 0.46568100 1.0 Zn Zn23 1 0.32903500 0.62003500 0.53431900 1.0 O O24 1 0.55569200 0.23139400 0.18976900 1.0 O O25 1 0.44430800 0.76860600 0.81023100 1.0 O O26 1 0.76860600 0.44430800 0.31023100 1.0 O O27 1 0.23139400 0.55569200 0.68976900 1.0 O O28 1 0.23545000 0.87745900 0.07891200 1.0 O O29 1 0.76455000 0.12254100 0.92108800 1.0 O O30 1 0.12254100 0.76455000 0.42108800 1.0 O O31 1 0.87745900 0.23545000 0.57891200 1.0 O O32 1 0.75825200 0.77045400 0.33661700 1.0 O O33 1 0.24174800 0.22954600 0.66338300 1.0 O O34 1 0.22954600 0.24174800 0.16338300 1.0 O O35 1 0.77045400 0.75825200 0.83661700 1.0 O O36 1 0.60234500 0.89828000 0.12152200 1.0 O O37 1 0.39765500 0.10172000 0.87847800 1.0 O O38 1 0.10172000 0.39765500 0.37847800 1.0 O O39 1 0.89828000 0.60234500 0.62152200 1.0 O O40 1 0.45520000 0.74819700 0.30416100 1.0 O O41 1 0.54480000 0.25180300 0.69583900 1.0 O O42 1 0.25180300 0.54480000 0.19583900 1.0 O O43 1 0.74819700 0.45520000 0.80416100 1.0 O O44 1 0.76721600 0.06466200 0.42626900 1.0 O O45 1 0.23278400 0.93533800 0.57373100 1.0 O O46 1 0.93533800 0.23278400 0.07373100 1.0 O O47 1 0.06466200 0.76721600 0.92626900 1.0 O O48 1 0.89060700 0.95257100 0.15561200 1.0 O O49 1 0.10939300 0.04742900 0.84438800 1.0 O O50 1 0.04742900 0.10939300 0.34438800 1.0 O O51 1 0.95257100 0.89060700 0.65561200 1.0 O O52 1 0.43097900 0.41016100 0.42746500 1.0 O O53 1 0.56902100 0.58983900 0.57253500 1.0 O O54 1 0.58983900 0.56902100 0.07253500 1.0 O O55 1 0.41016100 0.43097900 0.92746500 1.0 O O56 1 0.46004000 0.09165900 0.37533800 1.0 O O57 1 0.53996000 0.90834100 0.62466200 1.0 O O58 1 0.90834100 0.53996000 0.12466200 1.0 O O59 1 0.09165900 0.46004000 0.87533800 1.0