# generated using pymatgen data_Sc3(GaNi3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.39085183 _cell_length_b 7.39085248 _cell_length_c 7.39085184 _cell_angle_alpha 109.47121620 _cell_angle_beta 109.47121797 _cell_angle_gamma 109.47122153 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc3(GaNi3)2 _chemical_formula_sum 'Sc6 Ga4 Ni12' _cell_volume 310.78615835 _cell_formula_units_Z 2 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 0.71374734 0.71374734 0.00000000 1.0 Sc Sc1 1 0.28625266 1.00000000 0.28625266 1.0 Sc Sc2 1 1.00000000 0.28625266 0.28625266 1.0 Sc Sc3 1 0.28625266 0.28625266 1.00000000 1.0 Sc Sc4 1 0.71374734 0.00000000 0.71374734 1.0 Sc Sc5 1 0.00000000 0.71374734 0.71374734 1.0 Ga Ga6 1 0.00000000 0.00000000 0.50000000 1.0 Ga Ga7 1 0.00000000 0.50000000 0.00000000 1.0 Ga Ga8 1 0.50000000 0.00000000 0.00000000 1.0 Ga Ga9 1 0.50000000 0.50000000 0.50000000 1.0 Ni Ni10 1 0.34312140 0.34312140 0.68624381 1.0 Ni Ni11 1 0.65687860 0.00000000 0.34312140 1.0 Ni Ni12 1 0.00000000 0.65687860 0.34312140 1.0 Ni Ni13 1 0.65687860 0.34312140 0.00000000 1.0 Ni Ni14 1 0.34312140 0.68624381 0.34312140 1.0 Ni Ni15 1 0.00000000 0.34312140 0.65687860 1.0 Ni Ni16 1 0.34312140 0.65687860 1.00000000 1.0 Ni Ni17 1 0.34312140 1.00000000 0.65687860 1.0 Ni Ni18 1 0.68624381 0.34312140 0.34312140 1.0 Ni Ni19 1 0.65687860 0.65687860 0.31375619 1.0 Ni Ni20 1 0.65687860 0.31375619 0.65687860 1.0 Ni Ni21 1 0.31375619 0.65687860 0.65687860 1.0