# generated using pymatgen data_Zr10InB2Sb5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.51267003 _cell_length_b 8.51266967 _cell_length_c 5.78899600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99435115 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr10InB2Sb5 _chemical_formula_sum 'Zr10 In1 B2 Sb5' _cell_volume 363.32073141 _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 Zr Zr0 1 0.66963835 0.33259199 0.99961401 1.0 Zr Zr1 1 0.33259199 0.66963835 0.99961401 1.0 Zr Zr2 1 0.33259199 0.66963835 0.50038599 1.0 Zr Zr3 1 0.66963835 0.33259199 0.50038599 1.0 Zr Zr4 1 0.76741067 0.76741067 0.75000000 1.0 Zr Zr5 1 0.23416404 0.00106096 0.75000000 1.0 Zr Zr6 1 0.00106096 0.23416404 0.75000000 1.0 Zr Zr7 1 0.22933375 0.22933375 0.25000000 1.0 Zr Zr8 1 0.76633085 0.99839502 0.25000000 1.0 Zr Zr9 1 0.99839502 0.76633085 0.25000000 1.0 In In10 1 0.40049384 0.40049384 0.75000000 1.0 B B11 1 0.00009359 0.00009359 0.99864483 1.0 B B12 1 0.00009359 0.00009359 0.50135517 1.0 Sb Sb13 1 0.60261253 0.00029395 0.75000000 1.0 Sb Sb14 1 0.00029395 0.60261253 0.75000000 1.0 Sb Sb15 1 0.59457412 0.59457412 0.25000000 1.0 Sb Sb16 1 0.39852821 0.00215521 0.25000000 1.0 Sb Sb17 1 0.00215521 0.39852821 0.25000000 1.0