# generated using pymatgen data_Nb3Al2BPt _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.42156440 _cell_length_b 8.42156476 _cell_length_c 8.42156321 _cell_angle_alpha 59.99999832 _cell_angle_beta 59.99999690 _cell_angle_gamma 59.99999935 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb3Al2BPt _chemical_formula_sum 'Nb12 Al8 B4 Pt4' _cell_volume 422.34101888 _cell_formula_units_Z 4 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 Nb Nb0 1 0.56169755 0.93830245 0.56169755 1.0 Nb Nb1 1 0.31169755 0.68830245 0.68830245 1.0 Nb Nb2 1 0.68830245 0.31169755 0.31169755 1.0 Nb Nb3 1 0.31169755 0.68830245 0.31169755 1.0 Nb Nb4 1 0.68830245 0.68830245 0.31169755 1.0 Nb Nb5 1 0.31169755 0.31169755 0.68830245 1.0 Nb Nb6 1 0.56169755 0.56169755 0.93830245 1.0 Nb Nb7 1 0.93830245 0.56169755 0.56169755 1.0 Nb Nb8 1 0.56169755 0.93830245 0.93830245 1.0 Nb Nb9 1 0.93830245 0.93830245 0.56169755 1.0 Nb Nb10 1 0.68830245 0.31169755 0.68830245 1.0 Nb Nb11 1 0.93830245 0.56169755 0.93830245 1.0 Al Al12 1 0.91583894 0.91583894 0.91583894 1.0 Al Al13 1 0.99751581 0.33416106 0.33416106 1.0 Al Al14 1 0.33416106 0.99751581 0.33416106 1.0 Al Al15 1 0.33416106 0.33416106 0.99751581 1.0 Al Al16 1 0.91583894 0.25248419 0.91583894 1.0 Al Al17 1 0.91583894 0.91583894 0.25248419 1.0 Al Al18 1 0.25248419 0.91583894 0.91583894 1.0 Al Al19 1 0.33416106 0.33416106 0.33416106 1.0 B B20 1 0.62500000 0.62500000 0.62500000 1.0 B B21 1 0.12500000 0.62500000 0.62500000 1.0 B B22 1 0.62500000 0.12500000 0.62500000 1.0 B B23 1 0.62500000 0.62500000 0.12500000 1.0 Pt Pt24 1 0.12500000 0.12500000 0.12500000 1.0 Pt Pt25 1 0.62500000 0.12500000 0.12500000 1.0 Pt Pt26 1 0.12500000 0.62500000 0.12500000 1.0 Pt Pt27 1 0.12500000 0.12500000 0.62500000 1.0