# generated using pymatgen data_Ti2Cr3Si _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.79868242 _cell_length_b 4.79868242 _cell_length_c 8.05145300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000577 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti2Cr3Si _chemical_formula_sum 'Ti4 Cr6 Si2' _cell_volume 160.56426154 _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 Ti Ti0 1 0.33333300 0.66666700 0.43762800 1.0 Ti Ti1 1 0.66666700 0.33333300 0.56237200 1.0 Ti Ti2 1 0.66666700 0.33333300 0.93762800 1.0 Ti Ti3 1 0.33333300 0.66666700 0.06237200 1.0 Cr Cr4 1 0.82723300 0.17276700 0.25000000 1.0 Cr Cr5 1 0.82723300 0.65446600 0.25000000 1.0 Cr Cr6 1 0.34553400 0.17276700 0.25000000 1.0 Cr Cr7 1 0.17276700 0.82723300 0.75000000 1.0 Cr Cr8 1 0.17276700 0.34553400 0.75000000 1.0 Cr Cr9 1 0.65446600 0.82723300 0.75000000 1.0 Si Si10 1 0.00000000 0.00000000 0.50000000 1.0 Si Si11 1 0.00000000 0.00000000 0.00000000 1.0