# generated using pymatgen data_Nd7(BrO6)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 15.72618327 _cell_length_b 15.72618327 _cell_length_c 4.38902300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999691 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd7(BrO6)3 _chemical_formula_sum 'Nd14 Br6 O36' _cell_volume 940.03747385 _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 Nd Nd0 1 0.53016900 0.87417900 0.75000000 1.0 Nd Nd1 1 0.46983100 0.12582100 0.25000000 1.0 Nd Nd2 1 0.34401000 0.46983100 0.75000000 1.0 Nd Nd3 1 0.65599000 0.53016900 0.25000000 1.0 Nd Nd4 1 0.12582100 0.65599000 0.75000000 1.0 Nd Nd5 1 0.87417900 0.34401000 0.25000000 1.0 Nd Nd6 1 0.89000900 0.15147700 0.75000000 1.0 Nd Nd7 1 0.10999100 0.84852300 0.25000000 1.0 Nd Nd8 1 0.26146800 0.10999100 0.75000000 1.0 Nd Nd9 1 0.73853200 0.89000900 0.25000000 1.0 Nd Nd10 1 0.84852300 0.73853200 0.75000000 1.0 Nd Nd11 1 0.15147700 0.26146800 0.25000000 1.0 Nd Nd12 1 0.66666700 0.33333300 0.75000000 1.0 Nd Nd13 1 0.33333300 0.66666700 0.25000000 1.0 Br Br14 1 0.55777000 0.61690500 0.75000000 1.0 Br Br15 1 0.44223000 0.38309500 0.25000000 1.0 Br Br16 1 0.05913500 0.44223000 0.75000000 1.0 Br Br17 1 0.94086500 0.55777000 0.25000000 1.0 Br Br18 1 0.38309500 0.94086500 0.75000000 1.0 Br Br19 1 0.61690500 0.05913500 0.25000000 1.0 O O20 1 0.83392900 0.35884000 0.75000000 1.0 O O21 1 0.16607100 0.64116000 0.25000000 1.0 O O22 1 0.52491100 0.16607100 0.75000000 1.0 O O23 1 0.47508900 0.83392900 0.25000000 1.0 O O24 1 0.64116000 0.47508900 0.75000000 1.0 O O25 1 0.35884000 0.52491100 0.25000000 1.0 O O26 1 0.72134500 0.96975000 0.75000000 1.0 O O27 1 0.27865500 0.03025000 0.25000000 1.0 O O28 1 0.24840500 0.27865500 0.75000000 1.0 O O29 1 0.75159500 0.72134500 0.25000000 1.0 O O30 1 0.03025000 0.75159500 0.75000000 1.0 O O31 1 0.96975000 0.24840500 0.25000000 1.0 O O32 1 0.81248200 0.97016300 0.75000000 1.0 O O33 1 0.18751800 0.02983700 0.25000000 1.0 O O34 1 0.15768200 0.18751800 0.75000000 1.0 O O35 1 0.84231800 0.81248200 0.25000000 1.0 O O36 1 0.02983700 0.84231800 0.75000000 1.0 O O37 1 0.97016300 0.15768200 0.25000000 1.0 O O38 1 0.82248900 0.25908600 0.75000000 1.0 O O39 1 0.17751100 0.74091400 0.25000000 1.0 O O40 1 0.43659700 0.17751100 0.75000000 1.0 O O41 1 0.56340300 0.82248900 0.25000000 1.0 O O42 1 0.74091400 0.56340300 0.75000000 1.0 O O43 1 0.25908600 0.43659700 0.25000000 1.0 O O44 1 0.74400200 0.81378100 0.75000000 1.0 O O45 1 0.25599800 0.18621900 0.25000000 1.0 O O46 1 0.06977900 0.25599800 0.75000000 1.0 O O47 1 0.93022100 0.74400200 0.25000000 1.0 O O48 1 0.18621900 0.93022100 0.75000000 1.0 O O49 1 0.81378100 0.06977900 0.25000000 1.0 O O50 1 0.43550700 0.70390500 0.75000000 1.0 O O51 1 0.56449300 0.29609500 0.25000000 1.0 O O52 1 0.26839800 0.56449300 0.75000000 1.0 O O53 1 0.73160200 0.43550700 0.25000000 1.0 O O54 1 0.29609500 0.73160200 0.75000000 1.0 O O55 1 0.70390500 0.26839800 0.25000000 1.0