# generated using pymatgen data_Ce5Cr3(P3Ir4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.70894797 _cell_length_b 12.70894842 _cell_length_c 3.97658749 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999885 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce5Cr3(P3Ir4)4 _chemical_formula_sum 'Ce5 Cr3 P12 Ir16' _cell_volume 556.23766978 _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 Ce Ce0 1 0.33333300 0.66666700 0.50000000 1.0 Ce Ce1 1 0.66666700 0.33333300 0.50000000 1.0 Ce Ce2 1 0.00000000 0.81298155 0.00000000 1.0 Ce Ce3 1 0.18701845 0.18701845 0.00000000 1.0 Ce Ce4 1 0.81298155 0.00000000 0.00000000 1.0 Cr Cr5 1 1.00000000 0.45578231 0.50000000 1.0 Cr Cr6 1 0.54421769 0.54421769 0.50000000 1.0 Cr Cr7 1 0.45578231 0.00000000 0.50000000 1.0 P P8 1 0.00000000 0.63511949 0.50000000 1.0 P P9 1 0.36488051 0.36488051 0.50000000 1.0 P P10 1 0.63511949 0.00000000 0.50000000 1.0 P P11 1 0.51927272 0.68531131 0.00000000 1.0 P P12 1 0.31468869 0.83396242 0.00000000 1.0 P P13 1 0.16603758 0.48072728 0.00000000 1.0 P P14 1 0.48072728 0.16603758 0.00000000 1.0 P P15 1 0.68531131 0.51927272 0.00000000 1.0 P P16 1 0.83396242 0.31468869 0.00000000 1.0 P P17 1 1.00000000 0.17977736 0.50000000 1.0 P P18 1 0.82022264 0.82022264 0.50000000 1.0 P P19 1 0.17977736 0.00000000 0.50000000 1.0 Ir Ir20 1 0.50913015 0.86959903 0.00000000 1.0 Ir Ir21 1 0.13040097 0.63953213 0.00000000 1.0 Ir Ir22 1 0.36046787 0.49086985 0.00000000 1.0 Ir Ir23 1 0.49086985 0.36046787 0.00000000 1.0 Ir Ir24 1 0.86959903 0.50913015 0.00000000 1.0 Ir Ir25 1 0.63953213 0.13040097 0.00000000 1.0 Ir Ir26 1 0.00000000 0.28161085 0.00000000 1.0 Ir Ir27 1 0.71838915 0.71838915 0.00000000 1.0 Ir Ir28 1 0.28161085 0.00000000 0.00000000 1.0 Ir Ir29 1 0.62245756 0.80114340 0.50000000 1.0 Ir Ir30 1 0.19885660 0.82131416 0.50000000 1.0 Ir Ir31 1 0.17868584 0.37754244 0.50000000 1.0 Ir Ir32 1 0.37754244 0.17868584 0.50000000 1.0 Ir Ir33 1 0.80114340 0.62245756 0.50000000 1.0 Ir Ir34 1 0.82131416 0.19885660 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.50000000 1.0