# generated using pymatgen data_Zr2Cr3Si _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.99475276 _cell_length_b 4.99475276 _cell_length_c 8.40830700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00001012 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr2Cr3Si _chemical_formula_sum 'Zr4 Cr6 Si2' _cell_volume 181.66327498 _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 Zr Zr0 1 0.33333300 0.66666700 0.43632200 1.0 Zr Zr1 1 0.66666700 0.33333300 0.56367800 1.0 Zr Zr2 1 0.66666700 0.33333300 0.93632200 1.0 Zr Zr3 1 0.33333300 0.66666700 0.06367800 1.0 Cr Cr4 1 0.82844300 0.17155700 0.25000000 1.0 Cr Cr5 1 0.82844300 0.65688500 0.25000000 1.0 Cr Cr6 1 0.34311500 0.17155700 0.25000000 1.0 Cr Cr7 1 0.17155700 0.82844300 0.75000000 1.0 Cr Cr8 1 0.17155700 0.34311500 0.75000000 1.0 Cr Cr9 1 0.65688500 0.82844300 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