# generated using pymatgen data_Sc2SnB2Ir5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.40477473 _cell_length_b 9.40477473 _cell_length_c 3.19951098 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2SnB2Ir5 _chemical_formula_sum 'Sc4 Sn2 B4 Ir10' _cell_volume 282.99606715 _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 Sc Sc0 1 0.67558012 0.17558012 0.00000000 1.0 Sc Sc1 1 0.32441988 0.82441988 0.00000000 1.0 Sc Sc2 1 0.17558012 0.32441988 0.00000000 1.0 Sc Sc3 1 0.82441988 0.67558012 0.00000000 1.0 Sn Sn4 1 0.00000000 0.00000000 0.00000000 1.0 Sn Sn5 1 0.50000000 0.50000000 0.00000000 1.0 B B6 1 0.12198912 0.62198912 0.00000000 1.0 B B7 1 0.87801088 0.37801088 0.00000000 1.0 B B8 1 0.62198912 0.87801088 0.00000000 1.0 B B9 1 0.37801088 0.12198912 0.00000000 1.0 Ir Ir10 1 0.22268819 0.07150219 0.50000000 1.0 Ir Ir11 1 0.77731181 0.92849781 0.50000000 1.0 Ir Ir12 1 0.07150219 0.77731181 0.50000000 1.0 Ir Ir13 1 0.72268819 0.42849781 0.50000000 1.0 Ir Ir14 1 0.92849781 0.22268819 0.50000000 1.0 Ir Ir15 1 0.27731181 0.57150219 0.50000000 1.0 Ir Ir16 1 0.57150219 0.72268819 0.50000000 1.0 Ir Ir17 1 0.42849781 0.27731181 0.50000000 1.0 Ir Ir18 1 0.50000000 0.00000000 0.50000000 1.0 Ir Ir19 1 0.00000000 0.50000000 0.50000000 1.0