# generated using pymatgen data_CrSi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.36556825 _cell_length_b 4.36556824 _cell_length_c 6.31202585 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999240 _symmetry_Int_Tables_number 1 _chemical_formula_structural CrSi2 _chemical_formula_sum 'Cr3 Si6' _cell_volume 104.17919506 _cell_formula_units_Z 3 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 0.00000000 0.50000000 0.33333300 1.0 Cr Cr1 1 0.50000000 0.50000000 0.66666700 1.0 Cr Cr2 1 0.50000000 0.00000000 -0.00000000 1.0 Si Si3 1 0.83381367 0.66762733 0.00000000 1.0 Si Si4 1 0.16618633 0.83381367 0.66666700 1.0 Si Si5 1 0.66762733 0.83381367 0.33333300 1.0 Si Si6 1 0.16618633 0.33237267 0.00000000 1.0 Si Si7 1 0.83381367 0.16618633 0.66666700 1.0 Si Si8 1 0.33237267 0.16618633 0.33333300 1.0