# generated using pymatgen data_Hf2Nb(MoP)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.84720655 _cell_length_b 6.89496483 _cell_length_c 3.38071929 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.23099378 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf2Nb(MoP)3 _chemical_formula_sum 'Hf2 Nb1 Mo3 P3' _cell_volume 137.90170315 _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 0.40129064 0.40430016 0.50000000 1.0 Hf Hf1 1 0.59870936 0.00300952 0.50000000 1.0 Nb Nb2 1 1.00000000 0.59589433 0.50000000 1.0 Mo Mo3 1 0.25104264 0.99593730 0.00000000 1.0 Mo Mo4 1 0.74895736 0.74489466 0.00000000 1.0 Mo Mo5 1 0.00000000 0.25454998 0.00000000 1.0 P P6 1 0.66794528 0.33524981 0.00000000 1.0 P P7 1 0.33205472 0.66730653 0.00000000 1.0 P P8 1 0.00000000 0.99885770 0.50000000 1.0