# generated using pymatgen data_MgNi20(B3Sb)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.44367864 _cell_length_b 7.44367878 _cell_length_c 7.44367851 _cell_angle_alpha 60.00000554 _cell_angle_beta 60.00000490 _cell_angle_gamma 60.00000890 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgNi20(B3Sb)2 _chemical_formula_sum 'Mg1 Ni20 B6 Sb2' _cell_volume 291.64055275 _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 Mg Mg0 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni1 1 1.00000000 1.00000000 0.66105169 1.0 Ni Ni2 1 0.38439304 0.84682087 0.38439304 1.0 Ni Ni3 1 0.66105169 0.33894831 0.00000000 1.0 Ni Ni4 1 0.00000000 0.33894831 0.66105169 1.0 Ni Ni5 1 0.66105169 1.00000000 1.00000000 1.0 Ni Ni6 1 0.00000000 0.00000000 0.33894831 1.0 Ni Ni7 1 0.66105169 1.00000000 0.33894831 1.0 Ni Ni8 1 0.00000000 0.33894831 0.00000000 1.0 Ni Ni9 1 1.00000000 0.66105169 0.33894831 1.0 Ni Ni10 1 0.33894831 0.00000000 0.00000000 1.0 Ni Ni11 1 1.00000000 0.66105169 1.00000000 1.0 Ni Ni12 1 0.33894831 0.00000000 0.66105169 1.0 Ni Ni13 1 0.38439304 0.38439304 0.38439304 1.0 Ni Ni14 1 0.33894831 0.66105169 1.00000000 1.0 Ni Ni15 1 0.61560696 0.15317913 0.61560696 1.0 Ni Ni16 1 0.38439304 0.38439304 0.84682087 1.0 Ni Ni17 1 0.84682087 0.38439304 0.38439304 1.0 Ni Ni18 1 0.61560696 0.61560696 0.61560696 1.0 Ni Ni19 1 0.15317913 0.61560696 0.61560696 1.0 Ni Ni20 1 0.61560696 0.61560696 0.15317913 1.0 B B21 1 0.72940526 0.72940526 0.27059474 1.0 B B22 1 0.72940526 0.27059474 0.72940526 1.0 B B23 1 0.27059474 0.72940526 0.27059474 1.0 B B24 1 0.72940526 0.27059474 0.27059474 1.0 B B25 1 0.27059474 0.72940526 0.72940526 1.0 B B26 1 0.27059474 0.27059474 0.72940526 1.0 Sb Sb27 1 0.25000000 0.25000000 0.25000000 1.0 Sb Sb28 1 0.75000000 0.75000000 0.75000000 1.0