# generated using pymatgen data_Sc3(Ga2Ni)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.21268728 _cell_length_b 4.21268728 _cell_length_c 19.90241300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99998876 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc3(Ga2Ni)2 _chemical_formula_sum 'Sc6 Ga8 Ni4' _cell_volume 305.88266035 _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 0.00000000 0.00000000 0.24153700 1.0 Sc Sc1 1 0.00000000 0.00000000 0.57462900 1.0 Sc Sc2 1 0.00000000 0.00000000 0.90881900 1.0 Sc Sc3 1 0.00000000 0.00000000 0.09098400 1.0 Sc Sc4 1 0.00000000 0.00000000 0.42120700 1.0 Sc Sc5 1 0.00000000 0.00000000 0.75497100 1.0 Ga Ga6 1 0.66666700 0.33333300 0.49460300 1.0 Ga Ga7 1 0.66666700 0.33333300 0.82859200 1.0 Ga Ga8 1 0.66666700 0.33333300 0.01918100 1.0 Ga Ga9 1 0.66666700 0.33333300 0.34793400 1.0 Ga Ga10 1 0.66666700 0.33333300 0.68297900 1.0 Ga Ga11 1 0.33333300 0.66666700 0.31457800 1.0 Ga Ga12 1 0.33333300 0.66666700 0.64589700 1.0 Ga Ga13 1 0.33333300 0.66666700 0.98004900 1.0 Ni Ni14 1 0.33333300 0.66666700 0.18194900 1.0 Ni Ni15 1 0.33333300 0.66666700 0.51244400 1.0 Ni Ni16 1 0.33333300 0.66666700 0.84790500 1.0 Ni Ni17 1 0.66666700 0.33333300 0.15174300 1.0