# generated using pymatgen data_Cr5NiSn12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.51515591 _cell_length_b 5.51515591 _cell_length_c 13.65167800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.76019902 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr5NiSn12 _chemical_formula_sum 'Cr5 Ni1 Sn12' _cell_volume 360.47621876 _cell_formula_units_Z 1 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 0.00000000 0.16897400 1.0 Cr Cr1 1 0.00000000 0.00000000 0.83102600 1.0 Cr Cr2 1 0.50000000 0.00000000 0.16696500 1.0 Cr Cr3 1 0.00000000 0.50000000 0.83303500 1.0 Cr Cr4 1 0.50000000 0.50000000 0.50000000 1.0 Ni Ni5 1 0.00000000 0.00000000 0.50000000 1.0 Sn Sn6 1 0.16818000 0.33053700 0.66469700 1.0 Sn Sn7 1 0.66946300 0.83182000 0.33530300 1.0 Sn Sn8 1 0.16569400 0.83430600 0.00000000 1.0 Sn Sn9 1 0.83182000 0.66946300 0.66469700 1.0 Sn Sn10 1 0.33053700 0.16818000 0.33530300 1.0 Sn Sn11 1 0.83430600 0.16569400 0.00000000 1.0 Sn Sn12 1 0.50000000 0.00000000 0.55423700 1.0 Sn Sn13 1 0.00000000 0.50000000 0.22291500 1.0 Sn Sn14 1 0.50000000 0.50000000 0.88941600 1.0 Sn Sn15 1 0.50000000 0.00000000 0.77708500 1.0 Sn Sn16 1 0.50000000 0.50000000 0.11058400 1.0 Sn Sn17 1 0.00000000 0.50000000 0.44576300 1.0