# generated using pymatgen data_Sc3Ni(BRh2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.30419106 _cell_length_b 9.30419106 _cell_length_c 3.11261891 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc3Ni(BRh2)2 _chemical_formula_sum 'Sc6 Ni2 B4 Rh8' _cell_volume 269.45310428 _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 Sc Sc0 1 0.82241495 0.32241495 0.00000000 1.0 Sc Sc1 1 0.32241495 0.17758505 0.00000000 1.0 Sc Sc2 1 0.67758505 0.82241495 0.00000000 1.0 Sc Sc3 1 0.17758505 0.67758505 0.00000000 1.0 Sc Sc4 1 0.00000000 0.00000000 0.00000000 1.0 Sc Sc5 1 0.50000000 0.50000000 0.00000000 1.0 Ni Ni6 1 0.50000000 0.00000000 0.50000000 1.0 Ni Ni7 1 0.00000000 0.50000000 0.50000000 1.0 B B8 1 0.61314838 0.11314838 0.00000000 1.0 B B9 1 0.11314838 0.38685162 0.00000000 1.0 B B10 1 0.88685162 0.61314838 0.00000000 1.0 B B11 1 0.38685162 0.88685162 0.00000000 1.0 Rh Rh12 1 0.06351417 0.23028686 0.50000000 1.0 Rh Rh13 1 0.23028686 0.93648583 0.50000000 1.0 Rh Rh14 1 0.76971314 0.06351417 0.50000000 1.0 Rh Rh15 1 0.93648583 0.76971314 0.50000000 1.0 Rh Rh16 1 0.43648583 0.73028686 0.50000000 1.0 Rh Rh17 1 0.56351417 0.26971314 0.50000000 1.0 Rh Rh18 1 0.73028686 0.56351417 0.50000000 1.0 Rh Rh19 1 0.26971314 0.43648583 0.50000000 1.0