# generated using pymatgen data_HfSc3(SiMo)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.51081664 _cell_length_b 6.99619566 _cell_length_c 8.19178201 _cell_angle_alpha 90.16928714 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfSc3(SiMo)4 _chemical_formula_sum 'Hf1 Sc3 Si4 Mo4' _cell_volume 201.20862157 _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 0.75000000 0.45650983 0.83305547 1.0 Sc Sc1 1 0.25000000 0.04359097 0.33350643 1.0 Sc Sc2 1 0.75000000 0.95597338 0.66660860 1.0 Sc Sc3 1 0.25000000 0.54292017 0.16480788 1.0 Si Si4 1 0.25000000 0.25723572 0.63723316 1.0 Si Si5 1 0.75000000 0.74149445 0.36245627 1.0 Si Si6 1 0.25000000 0.75692506 0.86350703 1.0 Si Si7 1 0.75000000 0.24259700 0.13726091 1.0 Mo Mo8 1 0.75000000 0.37272358 0.44244398 1.0 Mo Mo9 1 0.25000000 0.62726426 0.56064152 1.0 Mo Mo10 1 0.75000000 0.87190688 0.05921634 1.0 Mo Mo11 1 0.25000000 0.13085871 0.93926239 1.0