# generated using pymatgen data_Nd3RhBr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.37798686 _cell_length_b 10.37798712 _cell_length_c 10.37798743 _cell_angle_alpha 109.47122123 _cell_angle_beta 109.47122175 _cell_angle_gamma 109.47121630 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3RhBr3 _chemical_formula_sum 'Nd12 Rh4 Br12' _cell_volume 860.43388923 _cell_formula_units_Z 4 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 Nd Nd0 1 0.47006170 0.48503185 0.23503185 1.0 Nd Nd1 1 0.75000000 0.23503185 0.26496815 1.0 Nd Nd2 1 0.75000000 0.01496815 0.48503185 1.0 Nd Nd3 1 0.23503185 0.47006170 0.48503185 1.0 Nd Nd4 1 0.26496815 0.75000000 0.23503185 1.0 Nd Nd5 1 0.02993830 0.26496815 0.01496815 1.0 Nd Nd6 1 0.01496815 0.02993830 0.26496815 1.0 Nd Nd7 1 0.48503185 0.75000000 0.01496815 1.0 Nd Nd8 1 0.48503185 0.23503185 0.47006170 1.0 Nd Nd9 1 0.01496815 0.48503185 0.75000000 1.0 Nd Nd10 1 0.26496815 0.01496815 0.02993830 1.0 Nd Nd11 1 0.23503185 0.26496815 0.75000000 1.0 Rh Rh12 1 0.25000000 0.25000000 0.25000000 1.0 Rh Rh13 1 0.50000000 0.00000000 0.25000000 1.0 Rh Rh14 1 0.00000000 0.25000000 0.50000000 1.0 Rh Rh15 1 0.25000000 0.50000000 0.00000000 1.0 Br Br16 1 0.25000000 0.75674386 0.74325614 1.0 Br Br17 1 0.51348673 0.50674386 0.75674386 1.0 Br Br18 1 0.98651327 0.74325614 0.99325614 1.0 Br Br19 1 0.74325614 0.25000000 0.75674386 1.0 Br Br20 1 0.99325614 0.98651327 0.74325614 1.0 Br Br21 1 0.25000000 0.99325614 0.50674386 1.0 Br Br22 1 0.75674386 0.51348673 0.50674386 1.0 Br Br23 1 0.50674386 0.25000000 0.99325614 1.0 Br Br24 1 0.75674386 0.74325614 0.25000000 1.0 Br Br25 1 0.74325614 0.99325614 0.98651327 1.0 Br Br26 1 0.99325614 0.50674386 0.25000000 1.0 Br Br27 1 0.50674386 0.75674386 0.51348673 1.0