# generated using pymatgen data_Sc4AlGaNi6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.01978206 _cell_length_b 5.01978192 _cell_length_c 7.84003968 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000091 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc4AlGaNi6 _chemical_formula_sum 'Sc4 Al1 Ga1 Ni6' _cell_volume 171.08762629 _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 0.33333300 0.66666700 0.44063698 1.0 Sc Sc1 1 0.66666700 0.33333300 0.55936302 1.0 Sc Sc2 1 0.66666700 0.33333300 0.94066527 1.0 Sc Sc3 1 0.33333300 0.66666700 0.05933473 1.0 Al Al4 1 0.00000000 0.00000000 0.50000000 1.0 Ga Ga5 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni6 1 0.82933704 0.17066296 0.25131852 1.0 Ni Ni7 1 0.82933704 0.65867409 0.25131852 1.0 Ni Ni8 1 0.34132591 0.17066296 0.25131852 1.0 Ni Ni9 1 0.17066296 0.82933704 0.74868148 1.0 Ni Ni10 1 0.17066296 0.34132591 0.74868148 1.0 Ni Ni11 1 0.65867409 0.82933704 0.74868148 1.0