# generated using pymatgen data_Tb2Nd2PBr6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.07917640 _cell_length_b 13.39707242 _cell_length_c 14.04914078 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb2Nd2PBr6 _chemical_formula_sum 'Tb4 Nd4 P2 Br12' _cell_volume 767.77179749 _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 Tb Tb0 1 0.50000000 0.11592487 0.34362608 1.0 Tb Tb1 1 0.50000000 0.88407513 0.65637392 1.0 Tb Tb2 1 0.50000000 0.61592487 0.15637392 1.0 Tb Tb3 1 0.50000000 0.38407513 0.84362608 1.0 Nd Nd4 1 0.00000000 0.11796339 0.57915910 1.0 Nd Nd5 1 0.00000000 0.88203661 0.42084090 1.0 Nd Nd6 1 0.00000000 0.61796339 0.92084090 1.0 Nd Nd7 1 0.00000000 0.38203661 0.07915910 1.0 P P8 1 0.50000000 0.00000000 0.50000000 1.0 P P9 1 0.50000000 0.50000000 0.00000000 1.0 Br Br10 1 0.50000000 0.23896592 0.16862198 1.0 Br Br11 1 0.50000000 0.76103408 0.83137802 1.0 Br Br12 1 0.50000000 0.73896592 0.33137802 1.0 Br Br13 1 0.50000000 0.26103408 0.66862198 1.0 Br Br14 1 0.00000000 0.25308190 0.40718301 1.0 Br Br15 1 0.00000000 0.74691810 0.59281699 1.0 Br Br16 1 0.00000000 0.75308190 0.09281699 1.0 Br Br17 1 0.00000000 0.24691810 0.90718301 1.0 Br Br18 1 0.00000000 0.00633035 0.24213813 1.0 Br Br19 1 0.00000000 0.99366965 0.75786187 1.0 Br Br20 1 0.00000000 0.50633035 0.25786187 1.0 Br Br21 1 0.00000000 0.49366965 0.74213813 1.0