# generated using pymatgen data_Ca4Zn51 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 14.87655675 _cell_length_b 14.87655675 _cell_length_c 14.87655630 _cell_angle_alpha 33.82745745 _cell_angle_beta 33.82745745 _cell_angle_gamma 33.82745578 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca4Zn51 _chemical_formula_sum 'Ca4 Zn51' _cell_volume 909.23586189 _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 Ca Ca0 1 0.87499500 0.87499500 0.87499500 1.0 Ca Ca1 1 0.37549200 0.37549200 0.37549200 1.0 Ca Ca2 1 0.12500500 0.12500500 0.12500500 1.0 Ca Ca3 1 0.62450800 0.62450800 0.62450800 1.0 Zn Zn4 1 0.71775600 0.47958600 0.08272800 1.0 Zn Zn5 1 0.21886000 0.97853700 0.58122300 1.0 Zn Zn6 1 0.40085000 0.15854100 0.03892700 1.0 Zn Zn7 1 0.90036200 0.66009000 0.53943100 1.0 Zn Zn8 1 0.28224400 0.52041400 0.91727200 1.0 Zn Zn9 1 0.78114000 0.02146300 0.41877700 1.0 Zn Zn10 1 0.59915000 0.84145900 0.96107300 1.0 Zn Zn11 1 0.09963800 0.33991000 0.46056900 1.0 Zn Zn12 1 0.82312800 0.23721400 0.46861500 1.0 Zn Zn13 1 0.33238600 0.72962700 0.96737100 1.0 Zn Zn14 1 0.29428900 0.41414700 0.64510300 1.0 Zn Zn15 1 0.78912000 0.90807200 0.15118800 1.0 Zn Zn16 1 0.70571100 0.58585300 0.35489700 1.0 Zn Zn17 1 0.21088000 0.09192800 0.84881200 1.0 Zn Zn18 1 0.17687200 0.76278600 0.53138500 1.0 Zn Zn19 1 0.66761400 0.27037300 0.03262900 1.0 Zn Zn20 1 0.15854100 0.03892700 0.40085000 1.0 Zn Zn21 1 0.66009000 0.53943100 0.90036200 1.0 Zn Zn22 1 0.47958600 0.08272800 0.71775600 1.0 Zn Zn23 1 0.97853700 0.58122300 0.21886000 1.0 Zn Zn24 1 0.84145900 0.96107300 0.59915000 1.0 Zn Zn25 1 0.33991000 0.46056900 0.09963800 1.0 Zn Zn26 1 0.52041400 0.91727200 0.28224400 1.0 Zn Zn27 1 0.02146300 0.41877700 0.78114000 1.0 Zn Zn28 1 0.41414700 0.64510300 0.29428900 1.0 Zn Zn29 1 0.90807200 0.15118800 0.78912000 1.0 Zn Zn30 1 0.23721400 0.46861500 0.82312800 1.0 Zn Zn31 1 0.72962700 0.96737100 0.33238600 1.0 Zn Zn32 1 0.76278600 0.53138500 0.17687200 1.0 Zn Zn33 1 0.27037300 0.03262900 0.66761400 1.0 Zn Zn34 1 0.58585300 0.35489700 0.70571100 1.0 Zn Zn35 1 0.09192800 0.84881200 0.21088000 1.0 Zn Zn36 1 0.91727200 0.28224400 0.52041400 1.0 Zn Zn37 1 0.41877700 0.78114000 0.02146300 1.0 Zn Zn38 1 0.96107300 0.59915000 0.84145900 1.0 Zn Zn39 1 0.46056900 0.09963800 0.33991000 1.0 Zn Zn40 1 0.08272800 0.71775600 0.47958600 1.0 Zn Zn41 1 0.58122300 0.21886000 0.97853700 1.0 Zn Zn42 1 0.03892700 0.40085000 0.15854100 1.0 Zn Zn43 1 0.53943100 0.90036200 0.66009000 1.0 Zn Zn44 1 0.35489700 0.70571100 0.58585300 1.0 Zn Zn45 1 0.84881200 0.21088000 0.09192800 1.0 Zn Zn46 1 0.53138500 0.17687200 0.76278600 1.0 Zn Zn47 1 0.03262900 0.66761400 0.27037300 1.0 Zn Zn48 1 0.46861500 0.82312800 0.23721400 1.0 Zn Zn49 1 0.96737100 0.33238600 0.72962700 1.0 Zn Zn50 1 0.64510300 0.29428900 0.41414700 1.0 Zn Zn51 1 0.15118800 0.78912000 0.90807200 1.0 Zn Zn52 1 0.00000000 0.00000000 0.00000000 1.0 Zn Zn53 1 0.75014100 0.75014100 0.75014100 1.0 Zn Zn54 1 0.24985900 0.24985900 0.24985900 1.0