# generated using pymatgen data_Sc6ZnNi6Sn5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.22324219 _cell_length_b 7.26226620 _cell_length_c 6.79837699 _cell_angle_alpha 90.00437548 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.82240368 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc6ZnNi6Sn5 _chemical_formula_sum 'Sc6 Zn1 Ni6 Sn5' _cell_volume 309.39596073 _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 Sc Sc0 1 0.40745562 0.00066232 0.24178247 1.0 Sc Sc1 1 0.60364293 0.61462997 0.24439665 1.0 Sc Sc2 1 0.98785504 0.38489367 0.24429004 1.0 Sc Sc3 1 0.40679330 0.99933768 0.75821753 1.0 Sc Sc4 1 0.60296137 0.61510633 0.75570996 1.0 Sc Sc5 1 0.98901296 0.38537003 0.75560335 1.0 Zn Zn6 1 0.72513554 0.00000000 0.00000000 1.0 Ni Ni7 1 0.33385221 0.66801479 0.00176052 1.0 Ni Ni8 1 0.33430512 0.66422234 0.49781458 1.0 Ni Ni9 1 0.66583641 0.33198521 0.99823948 1.0 Ni Ni10 1 0.67008577 0.33577766 0.50218542 1.0 Ni Ni11 1 0.99904371 0.00001476 0.24795196 1.0 Ni Ni12 1 0.99902895 0.99998524 0.75204804 1.0 Sn Sn13 1 0.27540923 0.27142278 0.50002709 1.0 Sn Sn14 1 0.00398545 0.72857722 0.49997291 1.0 Sn Sn15 1 0.99757045 0.72983319 0.99995153 1.0 Sn Sn16 1 0.26773626 0.27016681 0.00004847 1.0 Sn Sn17 1 0.73029068 0.00000000 0.50000000 1.0