# generated using pymatgen data_Li2CrCl4 _symmetry_space_group_name_H-M C2/c _cell_length_a 10.16200000 _cell_length_b 10.17200000 _cell_length_c 7.44600000 _cell_angle_alpha 90.00000000 _cell_angle_beta 132.11000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 15 _chemical_formula_structural Li2CrCl4 _chemical_formula_sum 'Li8 Cr4 Cl16' _cell_volume 570.99175515 _cell_formula_units_Z 4 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' 2 '-x, -y, -z' 3 '-x, y, -z+1/2' 4 'x, -y, z+1/2' 5 'x+1/2, y+1/2, z' 6 '-x+1/2, -y+1/2, -z' 7 '-x+1/2, y+1/2, -z+1/2' 8 'x+1/2, -y+1/2, z+1/2' 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 Li Li0 4 0.00000000 0.19089527 0.75000000 1.0 Li Li1 4 0.00000000 0.50000000 0.00000000 1.0 Cr Cr2 4 0.25000000 0.25000000 0.50000000 1.0 Cl Cl3 8 0.01793688 0.25573633 0.50728671 1.0 Cl Cl4 8 0.24695242 0.00330847 0.50604065 1.0