# generated using pymatgen data_Zr2Co5P6Ru5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.71798118 _cell_length_b 10.35665608 _cell_length_c 11.84120550 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr2Co5P6Ru5 _chemical_formula_sum 'Zr4 Co10 P12 Ru10' _cell_volume 455.95571147 _cell_formula_units_Z 2 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 0.25000000 0.58534946 0.70874726 1.0 Zr Zr1 1 0.25000000 0.91465054 0.20874726 1.0 Zr Zr2 1 0.75000000 0.42079879 0.29345951 1.0 Zr Zr3 1 0.75000000 0.07920121 0.79345951 1.0 Co Co4 1 0.75000000 0.77201764 0.82246827 1.0 Co Co5 1 0.75000000 0.72798236 0.32246827 1.0 Co Co6 1 0.25000000 0.87885046 0.70079788 1.0 Co Co7 1 0.25000000 0.62114954 0.20079788 1.0 Co Co8 1 0.75000000 0.10889494 0.29886176 1.0 Co Co9 1 0.75000000 0.39110506 0.79886176 1.0 Co Co10 1 0.25000000 0.46243316 0.93100471 1.0 Co Co11 1 0.25000000 0.03756684 0.43100471 1.0 Co Co12 1 0.75000000 0.53671988 0.06771489 1.0 Co Co13 1 0.75000000 0.96328012 0.56771489 1.0 P P14 1 0.25000000 0.43125693 0.11475379 1.0 P P15 1 0.25000000 0.06874307 0.61475379 1.0 P P16 1 0.75000000 0.57710525 0.88600278 1.0 P P17 1 0.75000000 0.92289475 0.38600278 1.0 P P18 1 0.25000000 0.26847933 0.86892022 1.0 P P19 1 0.25000000 0.23152067 0.36892022 1.0 P P20 1 0.75000000 0.72914098 0.13789723 1.0 P P21 1 0.75000000 0.77085902 0.63789723 1.0 P P22 1 0.25000000 0.60343795 0.38390340 1.0 P P23 1 0.25000000 0.89656205 0.88390340 1.0 P P24 1 0.75000000 0.40255214 0.61368759 1.0 P P25 1 0.75000000 0.09744786 0.11368759 1.0 Ru Ru26 1 0.25000000 0.70519890 0.98342184 1.0 Ru Ru27 1 0.25000000 0.79480110 0.48342184 1.0 Ru Ru28 1 0.75000000 0.29140303 0.00867279 1.0 Ru Ru29 1 0.75000000 0.20859697 0.50867279 1.0 Ru Ru30 1 0.25000000 0.40887518 0.48188083 1.0 Ru Ru31 1 0.25000000 0.09112482 0.98188083 1.0 Ru Ru32 1 0.75000000 0.59885632 0.51857543 1.0 Ru Ru33 1 0.75000000 0.90114368 0.01857543 1.0 Ru Ru34 1 0.25000000 0.22794022 0.17922881 1.0 Ru Ru35 1 0.25000000 0.27205978 0.67922881 1.0