# generated using pymatgen data_Ce5Cu19P12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.88898442 _cell_length_b 12.58705231 _cell_length_c 12.58597344 _cell_angle_alpha 119.99193680 _cell_angle_beta 89.64177262 _cell_angle_gamma 90.18427436 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce5Cu19P12 _chemical_formula_sum 'Ce5 Cu19 P12' _cell_volume 533.58605686 _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 0.99968741 0.33308258 0.66645748 1.0 Ce Ce1 1 0.99972326 0.66677194 0.33333818 1.0 Ce Ce2 1 0.49952249 0.81371606 0.81371064 1.0 Ce Ce3 1 0.49828099 0.00045063 0.18655507 1.0 Ce Ce4 1 0.49966092 0.18670092 0.00010102 1.0 Cu Cu5 1 0.50860551 0.52134673 0.63962779 1.0 Cu Cu6 1 0.48721144 0.11804397 0.47859720 1.0 Cu Cu7 1 0.51197087 0.36023874 0.88196356 1.0 Cu Cu8 1 0.48696878 0.88212069 0.36055367 1.0 Cu Cu9 1 0.51197362 0.63946901 0.52163652 1.0 Cu Cu10 1 0.50883110 0.47824016 0.11790663 1.0 Cu Cu11 1 0.99492188 0.61986356 0.82640984 1.0 Cu Cu12 1 0.99501785 0.20665623 0.37942035 1.0 Cu Cu13 1 0.00483068 0.17349108 0.79355233 1.0 Cu Cu14 1 0.99508944 0.79356872 0.17330268 1.0 Cu Cu15 1 0.00459815 0.82666680 0.62037174 1.0 Cu Cu16 1 0.99490841 0.38012255 0.20617375 1.0 Cu Cu17 1 0.99872596 0.00012885 0.00004131 1.0 Cu Cu18 1 0.50397382 0.71156330 0.00000421 1.0 Cu Cu19 1 0.50400614 0.28837176 0.28819956 1.0 Cu Cu20 1 0.49641351 0.00006724 0.71201630 1.0 Cu Cu21 1 0.07849267 0.54521725 0.00044222 1.0 Cu Cu22 1 0.07888550 0.45427629 0.45463969 1.0 Cu Cu23 1 0.91954717 0.99987999 0.54529565 1.0 P P24 1 0.99775148 0.00039823 0.82468052 1.0 P P25 1 0.00158906 0.82451978 0.00005365 1.0 P P26 1 0.00161070 0.17588385 0.17533335 1.0 P P27 1 0.50373177 0.17325562 0.68837614 1.0 P P28 1 0.49422838 0.51474871 0.82662859 1.0 P P29 1 0.49682382 0.31135794 0.48471765 1.0 P P30 1 0.49428992 0.48482833 0.31161241 1.0 P P31 1 0.49691713 0.68814590 0.17299891 1.0 P P32 1 0.50365055 0.82694273 0.51536691 1.0 P P33 1 0.00235042 0.63831157 0.63850054 1.0 P P34 1 0.99475894 0.99999874 0.36148494 1.0 P P35 1 0.00245026 0.36145356 -0.00007100 1.0