# generated using pymatgen data_CaY2(Ga2Ni3)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.92821015 _cell_length_b 8.92820945 _cell_length_c 3.83662362 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000262 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaY2(Ga2Ni3)3 _chemical_formula_sum 'Ca1 Y2 Ga6 Ni9' _cell_volume 264.85525298 _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 Ca Ca0 1 0.00000000 0.00000000 0.00000000 1.0 Y Y1 1 0.33333300 0.66666700 0.50000000 1.0 Y Y2 1 0.66666700 0.33333300 0.50000000 1.0 Ga Ga3 1 0.31742687 0.31742687 0.50000000 1.0 Ga Ga4 1 0.68257313 0.00000000 0.50000000 1.0 Ga Ga5 1 0.68257313 0.68257313 0.50000000 1.0 Ga Ga6 1 0.00000000 0.31742687 0.50000000 1.0 Ga Ga7 1 1.00000000 0.68257313 0.50000000 1.0 Ga Ga8 1 0.31742687 0.00000000 0.50000000 1.0 Ni Ni9 1 0.18180944 0.36361788 0.00000000 1.0 Ni Ni10 1 0.81819056 0.63638212 0.00000000 1.0 Ni Ni11 1 0.18180944 0.81819056 0.00000000 1.0 Ni Ni12 1 0.63638212 0.81819056 0.00000000 1.0 Ni Ni13 1 0.36361788 0.18180944 0.00000000 1.0 Ni Ni14 1 0.81819056 0.18180944 0.00000000 1.0 Ni Ni15 1 0.50000000 0.00000000 0.00000000 1.0 Ni Ni16 1 0.00000000 0.50000000 0.00000000 1.0 Ni Ni17 1 0.50000000 0.50000000 0.00000000 1.0