# generated using pymatgen data_HfSc(SnRh)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.46587341 _cell_length_b 7.46587273 _cell_length_c 6.98709026 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000734 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfSc(SnRh)2 _chemical_formula_sum 'Hf3 Sc3 Sn6 Rh6' _cell_volume 337.27811133 _cell_formula_units_Z 3 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 Hf Hf0 1 0.00013185 0.39213343 0.75000000 1.0 Hf Hf1 1 0.60786657 0.60799843 0.75000000 1.0 Hf Hf2 1 0.39200157 0.99986815 0.75000000 1.0 Sc Sc3 1 0.99993887 0.39617734 0.25000000 1.0 Sc Sc4 1 0.60382266 0.60376052 0.25000000 1.0 Sc Sc5 1 0.39623948 0.00006113 0.25000000 1.0 Sn Sn6 1 0.27381495 0.27375831 0.49847729 1.0 Sn Sn7 1 0.99994336 0.72618505 0.49847729 1.0 Sn Sn8 1 0.99994336 0.72618505 0.00152271 1.0 Sn Sn9 1 0.72624169 0.00005664 0.49847729 1.0 Sn Sn10 1 0.72624169 0.00005664 0.00152271 1.0 Sn Sn11 1 0.27381495 0.27375831 0.00152271 1.0 Rh Rh12 1 0.33333300 0.66666700 0.52154719 1.0 Rh Rh13 1 0.66666700 0.33333300 0.52189626 1.0 Rh Rh14 1 0.33333300 0.66666700 0.97845281 1.0 Rh Rh15 1 0.00000000 0.00000000 0.75000000 1.0 Rh Rh16 1 0.00000000 0.00000000 0.25000000 1.0 Rh Rh17 1 0.66666700 0.33333300 0.97810374 1.0