# generated using pymatgen data_Pa3NbSn5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.19478372 _cell_length_b 9.19478376 _cell_length_c 6.11435900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99547427 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pa3NbSn5 _chemical_formula_sum 'Pa6 Nb2 Sn10' _cell_volume 447.69723073 _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 Pa Pa0 1 0.61178297 0.99992704 0.25000000 1.0 Pa Pa1 1 0.38821703 0.00007296 0.75000000 1.0 Pa Pa2 1 0.99992704 0.61178297 0.25000000 1.0 Pa Pa3 1 0.00007296 0.38821703 0.75000000 1.0 Pa Pa4 1 0.38821577 0.38821577 0.25000000 1.0 Pa Pa5 1 0.61178423 0.61178423 0.75000000 1.0 Nb Nb6 1 0.00000000 0.00000000 0.00000000 1.0 Nb Nb7 1 0.00000000 0.00000000 0.50000000 1.0 Sn Sn8 1 0.26616482 0.99991644 0.25000000 1.0 Sn Sn9 1 0.73383518 0.00008356 0.75000000 1.0 Sn Sn10 1 0.99991644 0.26616482 0.25000000 1.0 Sn Sn11 1 0.00008356 0.73383518 0.75000000 1.0 Sn Sn12 1 0.73393639 0.73393639 0.25000000 1.0 Sn Sn13 1 0.26606361 0.26606361 0.75000000 1.0 Sn Sn14 1 0.33323517 0.66676483 0.00000000 1.0 Sn Sn15 1 0.66676483 0.33323517 0.00000000 1.0 Sn Sn16 1 0.66676483 0.33323517 0.50000000 1.0 Sn Sn17 1 0.33323517 0.66676483 0.50000000 1.0