# generated using pymatgen data_MgCr3P4Ru3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.14659498 _cell_length_b 7.14659591 _cell_length_c 3.37052404 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000486 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgCr3P4Ru3 _chemical_formula_sum 'Mg1 Cr3 P4 Ru3' _cell_volume 149.08242093 _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 Mg Mg0 1 0.00000000 0.00000000 0.00000000 1.0 Cr Cr1 1 0.45865326 0.91730652 0.00000000 1.0 Cr Cr2 1 0.08269348 0.54134674 0.00000000 1.0 Cr Cr3 1 0.45865326 0.54134674 0.00000000 1.0 P P4 1 0.17967649 0.35935297 0.50000000 1.0 P P5 1 0.64064703 0.82032351 0.50000000 1.0 P P6 1 0.17967649 0.82032351 0.50000000 1.0 P P7 1 0.66666700 0.33333300 0.00000000 1.0 Ru Ru8 1 0.80095389 0.60190979 0.50000000 1.0 Ru Ru9 1 0.39809021 0.19904611 0.50000000 1.0 Ru Ru10 1 0.80095389 0.19904611 0.50000000 1.0