# generated using pymatgen data_Ce2P7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.41066520 _cell_length_b 9.41066468 _cell_length_c 3.92332111 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999746 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce2P7Ru12 _chemical_formula_sum 'Ce2 P7 Ru12' _cell_volume 300.90203155 _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 0.66666700 0.33333300 0.50000000 1.0 Ce Ce1 1 0.33333300 0.66666700 0.00000000 1.0 P P2 1 0.60292399 0.71378109 0.50000000 1.0 P P3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.28621891 0.88914290 0.50000000 1.0 P P5 1 0.11085710 0.39707601 0.50000000 1.0 P P6 1 0.89092298 0.58126917 0.00000000 1.0 P P7 1 0.41873083 0.30965381 0.00000000 1.0 P P8 1 0.69034619 0.10907702 0.00000000 1.0 Ru Ru9 1 0.55799919 0.94674384 0.50000000 1.0 Ru Ru10 1 0.38874665 0.44200081 0.50000000 1.0 Ru Ru11 1 0.91081541 0.12208990 0.50000000 1.0 Ru Ru12 1 0.21127349 0.08918459 0.50000000 1.0 Ru Ru13 1 0.87791010 0.78872651 0.50000000 1.0 Ru Ru14 1 0.72879863 0.88839165 0.00000000 1.0 Ru Ru15 1 0.11160835 0.84040698 0.00000000 1.0 Ru Ru16 1 0.15959302 0.27120137 0.00000000 1.0 Ru Ru17 1 0.42815645 0.06920933 0.00000000 1.0 Ru Ru18 1 0.93079067 0.35894812 0.00000000 1.0 Ru Ru19 1 0.64105188 0.57184355 0.00000000 1.0 Ru Ru20 1 0.05325616 0.61125335 0.50000000 1.0