# generated using pymatgen data_Li2MnBr4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.05027000 _cell_length_b 6.05027000 _cell_length_c 8.16240400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2MnBr4 _chemical_formula_sum 'Li8 Mn4 Br16' _cell_volume 298.79105958 _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 Li Li0 1 0.00000000 0.75163100 0.50000000 1.0 Li Li1 1 0.75071000 0.00000000 0.75000000 1.0 Li Li2 1 0.00000000 0.24836900 0.00000000 1.0 Li Li3 1 0.24836900 0.00000000 0.75000000 1.0 Li Li4 1 0.24929000 0.00000000 0.25000000 1.0 Li Li5 1 0.75163100 0.00000000 0.25000000 1.0 Li Li6 1 0.00000000 0.24929000 0.50000000 1.0 Li Li7 1 0.00000000 0.75071000 0.00000000 1.0 Mn Mn8 1 0.25624500 0.50000000 0.25000000 1.0 Mn Mn9 1 0.50000000 0.25624500 0.50000000 1.0 Mn Mn10 1 0.74375500 0.50000000 0.75000000 1.0 Mn Mn11 1 0.50000000 0.74375500 0.00000000 1.0 Br Br12 1 0.74747500 0.01052900 0.99742100 1.0 Br Br13 1 0.98947100 0.74747500 0.24742100 1.0 Br Br14 1 0.98947100 0.25252500 0.25257900 1.0 Br Br15 1 0.25252500 0.01052900 0.00257900 1.0 Br Br16 1 0.25252500 0.98947100 0.49742100 1.0 Br Br17 1 0.25005400 0.51240700 0.52265800 1.0 Br Br18 1 0.51240700 0.74994600 0.27265800 1.0 Br Br19 1 0.51240700 0.25005400 0.22734200 1.0 Br Br20 1 0.48759300 0.25005400 0.77265800 1.0 Br Br21 1 0.48759300 0.74994600 0.72734200 1.0 Br Br22 1 0.74994600 0.51240700 0.47734200 1.0 Br Br23 1 0.74747500 0.98947100 0.50257900 1.0 Br Br24 1 0.74994600 0.48759300 0.02265800 1.0 Br Br25 1 0.01052900 0.25252500 0.74742100 1.0 Br Br26 1 0.01052900 0.74747500 0.75257900 1.0 Br Br27 1 0.25005400 0.48759300 0.97734200 1.0