# generated using pymatgen data_Zr4B8Mo3Ru7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.07683942 _cell_length_b 8.67160389 _cell_length_c 9.98626583 _cell_angle_alpha 90.38300048 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4B8Mo3Ru7 _chemical_formula_sum 'Zr4 B8 Mo3 Ru7' _cell_volume 266.43893025 _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 0.50000000 0.83605080 0.18040958 1.0 Zr Zr1 1 0.50000000 0.16357520 0.82171374 1.0 Zr Zr2 1 0.50000000 0.66180015 0.68237230 1.0 Zr Zr3 1 0.50000000 0.33883492 0.31469614 1.0 B B4 1 0.50000000 0.96565448 0.58795692 1.0 B B5 1 0.50000000 0.02942959 0.41182846 1.0 B B6 1 0.50000000 0.85305166 0.90154516 1.0 B B7 1 0.50000000 0.14976572 0.09998840 1.0 B B8 1 0.50000000 0.64800606 0.39944793 1.0 B B9 1 0.50000000 0.35083850 0.59905439 1.0 B B10 1 0.50000000 0.46626173 0.91342529 1.0 B B11 1 0.50000000 0.53392111 0.08498418 1.0 Mo Mo12 1 0.00000000 0.66301577 0.95158478 1.0 Mo Mo13 1 0.00000000 0.33683478 0.04697702 1.0 Mo Mo14 1 0.00000000 0.84030614 0.45475110 1.0 Ru Ru15 1 0.00000000 0.16543246 0.54848975 1.0 Ru Ru16 1 0.00000000 0.00063811 0.00145693 1.0 Ru Ru17 1 0.00000000 0.40691844 0.75767010 1.0 Ru Ru18 1 0.00000000 0.59055081 0.24016444 1.0 Ru Ru19 1 0.00000000 0.49710003 0.49987778 1.0 Ru Ru20 1 0.00000000 0.91213628 0.73895841 1.0 Ru Ru21 1 0.00000000 0.08987626 0.26264719 1.0