# generated using pymatgen data_Ti3Cr2Si3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.21221504 _cell_length_b 7.21221536 _cell_length_c 4.80394772 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999852 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3Cr2Si3 _chemical_formula_sum 'Ti6 Cr4 Si6' _cell_volume 216.40448863 _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 0.75889345 0.75889345 0.75000000 1.0 Ti Ti1 1 0.24110655 0.00000000 0.75000000 1.0 Ti Ti2 1 1.00000000 0.24110655 0.75000000 1.0 Ti Ti3 1 0.24110655 0.24110655 0.25000000 1.0 Ti Ti4 1 0.75889345 0.00000000 0.25000000 1.0 Ti Ti5 1 0.00000000 0.75889345 0.25000000 1.0 Cr Cr6 1 0.66666700 0.33333300 0.00000000 1.0 Cr Cr7 1 0.33333300 0.66666700 0.00000000 1.0 Cr Cr8 1 0.33333300 0.66666700 0.50000000 1.0 Cr Cr9 1 0.66666700 0.33333300 0.50000000 1.0 Si Si10 1 0.40360844 0.40360844 0.75000000 1.0 Si Si11 1 0.59639156 0.00000000 0.75000000 1.0 Si Si12 1 0.00000000 0.59639156 0.75000000 1.0 Si Si13 1 0.59639156 0.59639156 0.25000000 1.0 Si Si14 1 0.40360844 0.00000000 0.25000000 1.0 Si Si15 1 1.00000000 0.40360844 0.25000000 1.0