# generated using pymatgen data_Pr2MoC2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.84545270 _cell_length_b 5.84545270 _cell_length_c 10.50044410 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr2MoC2 _chemical_formula_sum 'Pr8 Mo4 C8' _cell_volume 358.79300591 _cell_formula_units_Z 4 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 Pr Pr0 1 0.80338940 0.80338940 0.65555014 1.0 Pr Pr1 1 0.19661060 0.19661060 0.65555014 1.0 Pr Pr2 1 0.80338940 0.80338940 0.34444986 1.0 Pr Pr3 1 0.30338940 0.69661060 0.15555014 1.0 Pr Pr4 1 0.69661060 0.30338940 0.15555014 1.0 Pr Pr5 1 0.69661060 0.30338940 0.84444986 1.0 Pr Pr6 1 0.30338940 0.69661060 0.84444986 1.0 Pr Pr7 1 0.19661060 0.19661060 0.34444986 1.0 Mo Mo8 1 0.17539926 0.17539926 -0.00000000 1.0 Mo Mo9 1 0.32460074 0.67539926 0.50000000 1.0 Mo Mo10 1 0.67539926 0.32460074 0.50000000 1.0 Mo Mo11 1 0.82460074 0.82460074 -0.00000000 1.0 C C12 1 0.50000000 -0.00000000 -0.00000000 1.0 C C13 1 0.50000000 -0.00000000 0.50000000 1.0 C C14 1 -0.00000000 0.50000000 0.50000000 1.0 C C15 1 -0.00000000 0.50000000 -0.00000000 1.0 C C16 1 -0.00000000 -0.00000000 0.85923504 1.0 C C17 1 0.50000000 0.50000000 0.35923504 1.0 C C18 1 0.50000000 0.50000000 0.64076496 1.0 C C19 1 0.00000000 -0.00000000 0.14076496 1.0