# generated using pymatgen data_Cr3C2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.81054521 _cell_length_b 4.80163199 _cell_length_c 6.84213668 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 107.01761047 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr3C2 _chemical_formula_sum 'Cr6 C4' _cell_volume 88.29308173 _cell_formula_units_Z 2 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 Cr Cr0 1 0.40083045 0.80166290 0.75000000 1.0 Cr Cr1 1 0.14312833 0.28625666 0.92950338 1.0 Cr Cr2 1 0.59916955 0.19833710 0.25000000 1.0 Cr Cr3 1 0.85687167 0.71374334 0.07049662 1.0 Cr Cr4 1 0.14312833 0.28625666 0.57049662 1.0 Cr Cr5 1 0.85687167 0.71374334 0.42950338 1.0 C C6 1 0.75583405 0.51166810 0.75000000 1.0 C C7 1 0.24416595 0.48833190 0.25000000 1.0 C C8 1 0.50000000 -0.00000000 0.00000000 1.0 C C9 1 0.50000000 -0.00000000 0.50000000 1.0