# generated using pymatgen data_MnZnSe4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.38744200 _cell_length_b 6.39114400 _cell_length_c 6.39122078 _cell_angle_alpha 89.83413372 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MnZnSe4 _chemical_formula_sum 'Mn2 Zn2 Se8' _cell_volume 260.90810645 _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 Mn Mn0 1 0.50000000 0.00000000 0.50000000 1.0 Mn Mn1 1 0.00000000 0.50000000 0.50000000 1.0 Zn Zn2 1 0.50000000 0.50000000 0.00000000 1.0 Zn Zn3 1 0.00000000 0.00000000 0.00000000 1.0 Se Se4 1 0.89130000 0.60863300 0.89074300 1.0 Se Se5 1 0.39130000 0.89136700 0.10925700 1.0 Se Se6 1 0.10958200 0.10946100 0.60912800 1.0 Se Se7 1 0.60958200 0.39053900 0.39087200 1.0 Se Se8 1 0.10870000 0.39136700 0.10925700 1.0 Se Se9 1 0.60870000 0.10863300 0.89074300 1.0 Se Se10 1 0.89041800 0.89053900 0.39087200 1.0 Se Se11 1 0.39041800 0.60946100 0.60912800 1.0