# generated using pymatgen data_MgSb2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.49506058 _cell_length_b 6.49506058 _cell_length_c 8.23015073 _cell_angle_alpha 79.49279711 _cell_angle_beta 79.49279711 _cell_angle_gamma 28.72173852 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgSb2 _chemical_formula_sum 'Mg2 Sb4' _cell_volume 163.86426382 _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 Mg Mg0 1 0.63222700 0.63222700 0.00688900 1.0 Mg Mg1 1 0.36777300 0.36777300 0.99311100 1.0 Sb Sb2 1 0.23840700 0.23840700 0.71049200 1.0 Sb Sb3 1 0.00130200 0.00130200 0.70923800 1.0 Sb Sb4 1 0.99869800 0.99869800 0.29076200 1.0 Sb Sb5 1 0.76159300 0.76159300 0.28950800 1.0