# generated using pymatgen data_Sc4Ga3Si3Ir7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.99315599 _cell_length_b 6.99315658 _cell_length_c 7.06655747 _cell_angle_alpha 109.68397301 _cell_angle_beta 109.68397475 _cell_angle_gamma 109.25763347 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc4Ga3Si3Ir7 _chemical_formula_sum 'Sc4 Ga3 Si3 Ir7' _cell_volume 265.32942306 _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 Sc Sc0 1 0.00000000 0.00000000 0.53628704 1.0 Sc Sc1 1 1.00000000 0.48484343 0.00224422 1.0 Sc Sc2 1 0.48484343 0.00000000 0.00224422 1.0 Sc Sc3 1 0.51515657 0.51515657 0.51740079 1.0 Ga Ga4 1 0.71098298 0.71098298 0.01361543 1.0 Ga Ga5 1 0.28901702 1.00000000 0.30263244 1.0 Ga Ga6 1 1.00000000 0.28901702 0.30263244 1.0 Si Si7 1 0.32883188 0.32883188 0.00542943 1.0 Si Si8 1 0.67116812 0.00000000 0.67659754 1.0 Si Si9 1 0.00000000 0.67116812 0.67659754 1.0 Ir Ir10 1 0.74730189 0.24852723 0.50044972 1.0 Ir Ir11 1 0.75147277 0.49877466 0.25192249 1.0 Ir Ir12 1 0.50122534 0.25269811 0.75314783 1.0 Ir Ir13 1 0.25269811 0.50122534 0.75314783 1.0 Ir Ir14 1 0.24852723 0.74730189 0.50044972 1.0 Ir Ir15 1 0.49877466 0.75147277 0.25192249 1.0 Ir Ir16 1 1.00000000 1.00000000 0.95327982 1.0