# generated using pymatgen data_Lu4Mn3VB16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.36134217 _cell_length_b 5.85336591 _cell_length_c 11.30878428 _cell_angle_alpha 90.06345333 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu4Mn3VB16 _chemical_formula_sum 'Lu4 Mn3 V1 B16' _cell_volume 222.50206766 _cell_formula_units_Z 1 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 Lu Lu0 1 0.50000000 0.37171913 0.14812527 1.0 Lu Lu1 1 0.50000000 0.62702218 0.84972480 1.0 Lu Lu2 1 0.50000000 0.12515104 0.65248083 1.0 Lu Lu3 1 0.50000000 0.87330014 0.34980731 1.0 Mn Mn4 1 0.50000000 0.62426977 0.58285533 1.0 Mn Mn5 1 0.50000000 0.12937811 0.91447894 1.0 Mn Mn6 1 0.50000000 0.87074866 0.08274990 1.0 V V7 1 0.50000000 0.37440012 0.41873254 1.0 B B8 1 0.00000000 0.11399403 0.04568373 1.0 B B9 1 0.00000000 0.88775766 0.95158256 1.0 B B10 1 0.00000000 0.38912481 0.55027746 1.0 B B11 1 0.00000000 0.61767444 0.45526634 1.0 B B12 1 0.00000000 0.13304456 0.46988193 1.0 B B13 1 0.00000000 0.86301390 0.53434499 1.0 B B14 1 0.00000000 0.36257669 0.96715664 1.0 B B15 1 0.00000000 0.63635236 0.03077773 1.0 B B16 1 0.00000000 0.02401395 0.19109334 1.0 B B17 1 0.00000000 0.97625050 0.80788033 1.0 B B18 1 0.00000000 0.47812087 0.69326058 1.0 B B19 1 0.00000000 0.52698619 0.30658362 1.0 B B20 1 0.00000000 0.21297438 0.31339871 1.0 B B21 1 0.00000000 0.78216200 0.68440530 1.0 B B22 1 0.00000000 0.28298749 0.81598507 1.0 B B23 1 0.00000000 0.71697602 0.18346474 1.0