# generated using pymatgen data_LuGaNi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.08463760 _cell_length_b 5.08463112 _cell_length_c 15.61219376 _cell_angle_alpha 89.99986137 _cell_angle_beta 90.00005717 _cell_angle_gamma 119.99839656 _symmetry_Int_Tables_number 1 _chemical_formula_structural LuGaNi2 _chemical_formula_sum 'Lu6 Ga6 Ni12' _cell_volume 349.55944154 _cell_formula_units_Z 6 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 Lu Lu0 1 0.33333098 0.66666375 0.54282707 1.0 Lu Lu1 1 0.66666949 0.33333743 0.45716697 1.0 Lu Lu2 1 0.66666686 0.33333516 0.04285982 1.0 Lu Lu3 1 0.33333107 0.66666566 0.95716160 1.0 Lu Lu4 1 0.33333638 0.66667373 0.74998842 1.0 Lu Lu5 1 0.66666577 0.33333223 0.25000272 1.0 Ga Ga6 1 0.00000308 0.00000029 0.24999971 1.0 Ga Ga7 1 -0.00000039 0.00000062 0.75000007 1.0 Ga Ga8 1 0.33333186 0.66666546 0.24999991 1.0 Ga Ga9 1 0.66666805 0.33333533 0.74999906 1.0 Ga Ga10 1 0.00000083 0.00000028 0.00002350 1.0 Ga Ga11 1 0.00000182 0.00000105 0.49997445 1.0 Ni Ni12 1 0.16893128 0.33786696 0.12565318 1.0 Ni Ni13 1 0.83107169 0.66213518 0.87440924 1.0 Ni Ni14 1 0.66213351 0.83107001 0.12565471 1.0 Ni Ni15 1 0.83107209 0.66213339 0.62557187 1.0 Ni Ni16 1 0.33786599 0.16892819 0.87440870 1.0 Ni Ni17 1 0.16892822 0.33786830 0.37436244 1.0 Ni Ni18 1 0.16893704 0.83106601 0.12565572 1.0 Ni Ni19 1 0.33786280 0.16892324 0.62557394 1.0 Ni Ni20 1 0.83106874 0.16893724 0.87440795 1.0 Ni Ni21 1 0.66212938 0.83106853 0.37436260 1.0 Ni Ni22 1 0.83105795 0.16892923 0.62557306 1.0 Ni Ni23 1 0.16893651 0.83106073 0.37436129 1.0