# generated using pymatgen data_Ni4P4PdRu3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.64633183 _cell_length_b 5.73486632 _cell_length_c 6.77665855 _cell_angle_alpha 91.25421716 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ni4P4PdRu3 _chemical_formula_sum 'Ni4 P4 Pd1 Ru3' _cell_volume 141.67428524 _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 Ni Ni0 1 0.75000000 0.36590085 0.56054563 1.0 Ni Ni1 1 0.75000000 0.87009041 0.93514399 1.0 Ni Ni2 1 0.25000000 0.62832433 0.43211528 1.0 Ni Ni3 1 0.25000000 0.14499863 0.06531686 1.0 P P4 1 0.75000000 0.24437265 0.86745004 1.0 P P5 1 0.75000000 0.74445309 0.62471905 1.0 P P6 1 0.25000000 0.77027546 0.12374723 1.0 P P7 1 0.25000000 0.23839510 0.38403492 1.0 Pd Pd8 1 0.75000000 0.47275890 0.16276674 1.0 Ru Ru9 1 0.75000000 0.96434914 0.33965693 1.0 Ru Ru10 1 0.25000000 0.53144241 0.83308398 1.0 Ru Ru11 1 0.25000000 0.02463701 0.67142038 1.0