# generated using pymatgen data_CeNd3(Co2I)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.06047680 _cell_length_b 4.06047525 _cell_length_c 17.60192158 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99998735 _symmetry_Int_Tables_number 1 _chemical_formula_structural CeNd3(Co2I)2 _chemical_formula_sum 'Ce1 Nd3 Co4 I2' _cell_volume 251.33019635 _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 0.00000000 0.00000000 0.10422301 1.0 Nd Nd1 1 0.00000000 0.00000000 0.89265645 1.0 Nd Nd2 1 0.00000000 0.00000000 0.60568007 1.0 Nd Nd3 1 0.00000000 0.00000000 0.39372011 1.0 Co Co4 1 0.33333300 0.66666700 0.50222855 1.0 Co Co5 1 0.66666700 0.33333300 0.49721809 1.0 Co Co6 1 0.66666700 0.33333300 0.00030711 1.0 Co Co7 1 0.33333300 0.66666700 0.00310493 1.0 I I8 1 0.33333300 0.66666700 0.25078057 1.0 I I9 1 0.66666700 0.33333300 0.75008111 1.0