# generated using pymatgen data_Zr3TcMo2P3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.91114832 _cell_length_b 6.87848485 _cell_length_c 3.43940829 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.84377009 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3TcMo2P3 _chemical_formula_sum 'Zr3 Tc1 Mo2 P3' _cell_volume 141.82046754 _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 Zr Zr0 1 0.40525882 0.40245475 0.50000000 1.0 Zr Zr1 1 0.59474118 0.99719593 0.50000000 1.0 Zr Zr2 1 1.00000000 0.59721157 0.50000000 1.0 Tc Tc3 1 1.00000000 0.25234811 0.00000000 1.0 Mo Mo4 1 0.25020354 0.00096979 0.00000000 1.0 Mo Mo5 1 0.74979646 0.75076625 0.00000000 1.0 P P6 1 0.66753119 0.33253993 0.00000000 1.0 P P7 1 0.33246881 0.66500973 0.00000000 1.0 P P8 1 1.00000000 0.00150294 0.50000000 1.0