# generated using pymatgen data_HfSc2(TcP)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.77682233 _cell_length_b 6.77682265 _cell_length_c 3.38390418 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.76023455 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfSc2(TcP)3 _chemical_formula_sum 'Hf1 Sc2 Tc3 P3' _cell_volume 134.91030309 _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 Hf Hf0 1 0.40305441 0.40305441 0.50000000 1.0 Sc Sc1 1 0.59608030 0.99850813 0.50000000 1.0 Sc Sc2 1 0.99850813 0.59608030 0.50000000 1.0 Tc Tc3 1 0.00282447 0.25073933 0.00000000 1.0 Tc Tc4 1 0.25073933 0.00282447 0.00000000 1.0 Tc Tc5 1 0.74946835 0.74946835 0.00000000 1.0 P P6 1 0.66702288 0.33291909 0.00000000 1.0 P P7 1 0.33291909 0.66702288 0.00000000 1.0 P P8 1 0.99938305 0.99938305 0.50000000 1.0