# generated using pymatgen data_Ce6Ni20P13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.75372265 _cell_length_b 12.75372265 _cell_length_c 3.81417100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000339 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce6Ni20P13 _chemical_formula_sum 'Ce6 Ni20 P13' _cell_volume 537.28499694 _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 0.53067700 0.81278100 0.00000000 1.0 Ce Ce1 1 0.28210400 0.46932300 0.00000000 1.0 Ce Ce2 1 0.18721900 0.71789600 0.00000000 1.0 Ce Ce3 1 0.81328400 0.28087500 0.50000000 1.0 Ce Ce4 1 0.46759100 0.18671600 0.50000000 1.0 Ce Ce5 1 0.71912500 0.53240900 0.50000000 1.0 Ni Ni6 1 0.80597800 0.91153700 0.00000000 1.0 Ni Ni7 1 0.10555900 0.19402200 0.00000000 1.0 Ni Ni8 1 0.08846300 0.89444100 0.00000000 1.0 Ni Ni9 1 0.33333300 0.66666700 0.50000000 1.0 Ni Ni10 1 0.92848600 0.08216700 0.50000000 1.0 Ni Ni11 1 0.15368100 0.07151400 0.50000000 1.0 Ni Ni12 1 0.91783300 0.84631900 0.50000000 1.0 Ni Ni13 1 0.66666700 0.33333300 0.00000000 1.0 Ni Ni14 1 0.56360000 0.58601900 0.00000000 1.0 Ni Ni15 1 0.02241800 0.43640000 0.00000000 1.0 Ni Ni16 1 0.41398100 0.97758200 0.00000000 1.0 Ni Ni17 1 0.68418100 0.75456500 0.50000000 1.0 Ni Ni18 1 0.07038400 0.31581900 0.50000000 1.0 Ni Ni19 1 0.24543500 0.92961600 0.50000000 1.0 Ni Ni20 1 0.97735800 0.56621700 0.50000000 1.0 Ni Ni21 1 0.58885900 0.02264200 0.50000000 1.0 Ni Ni22 1 0.43378300 0.41114100 0.50000000 1.0 Ni Ni23 1 0.75788700 0.07721800 0.00000000 1.0 Ni Ni24 1 0.31933100 0.24211300 0.00000000 1.0 Ni Ni25 1 0.92278200 0.68066900 0.00000000 1.0 P P26 1 0.47980100 0.61247200 0.50000000 1.0 P P27 1 0.13267100 0.52019900 0.50000000 1.0 P P28 1 0.38752800 0.86732900 0.50000000 1.0 P P29 1 0.72492400 0.95573500 0.50000000 1.0 P P30 1 0.23081100 0.27507600 0.50000000 1.0 P P31 1 0.04426500 0.76918900 0.50000000 1.0 P P32 1 0.86703800 0.47976300 0.00000000 1.0 P P33 1 0.61272500 0.13296200 0.00000000 1.0 P P34 1 0.52023700 0.38727500 0.00000000 1.0 P P35 1 0.95440600 0.23219400 0.00000000 1.0 P P36 1 0.27778900 0.04559400 0.00000000 1.0 P P37 1 0.76780600 0.72221100 0.00000000 1.0 P P38 1 0.00000000 0.00000000 0.00000000 1.0