# generated using pymatgen data_ZrTcP _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.74111531 _cell_length_b 6.74111663 _cell_length_c 3.53315376 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999833 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrTcP _chemical_formula_sum 'Zr3 Tc3 P3' _cell_volume 139.04544731 _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 Zr Zr0 1 0.40740778 0.40740778 0.50000000 1.0 Zr Zr1 1 0.59259222 0.00000000 0.50000000 1.0 Zr Zr2 1 1.00000000 0.59259222 0.50000000 1.0 Tc Tc3 1 0.00000000 0.24416468 0.00000000 1.0 Tc Tc4 1 0.24416468 1.00000000 0.00000000 1.0 Tc Tc5 1 0.75583532 0.75583532 0.00000000 1.0 P P6 1 0.66666700 0.33333300 0.00000000 1.0 P P7 1 0.33333300 0.66666700 0.00000000 1.0 P P8 1 0.00000000 0.00000000 0.50000000 1.0