# generated using pymatgen data_CaCe2(TaN3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.99540743 _cell_length_b 3.99540738 _cell_length_c 10.31873031 _cell_angle_alpha 101.16293499 _cell_angle_beta 101.16293233 _cell_angle_gamma 89.99999752 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaCe2(TaN3)2 _chemical_formula_sum 'Ca1 Ce2 Ta2 N6' _cell_volume 158.42665875 _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 0.18371041 0.18371041 0.36741983 1.0 Ce Ce1 1 0.00276365 0.00276365 0.00552629 1.0 Ce Ce2 1 0.81506862 0.81506862 0.63013725 1.0 Ta Ta3 1 0.60193790 0.60193790 0.20387580 1.0 Ta Ta4 1 0.39967671 0.39967671 0.79935442 1.0 N N5 1 0.57860569 0.07860569 0.15721039 1.0 N N6 1 0.07860569 0.57860569 0.15721039 1.0 N N7 1 0.69861046 0.69861046 0.39722093 1.0 N N8 1 0.30264134 0.30264134 0.60528368 1.0 N N9 1 0.91919026 0.41919026 0.83838052 1.0 N N10 1 0.41919026 0.91919026 0.83838052 1.0