# generated using pymatgen data_Ni6Sn5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.46167423 _cell_length_b 6.46167453 _cell_length_c 9.48110613 _cell_angle_alpha 81.12955777 _cell_angle_beta 81.12955685 _cell_angle_gamma 65.22747783 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ni6Sn5 _chemical_formula_sum 'Ni12 Sn10' _cell_volume 353.36432582 _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 Ni Ni0 1 0.38649120 0.41468497 0.70101606 1.0 Ni Ni1 1 0.58531503 0.61350880 0.79898394 1.0 Ni Ni2 1 0.61350880 0.58531503 0.29898394 1.0 Ni Ni3 1 0.41468497 0.38649120 0.20101606 1.0 Ni Ni4 1 0.19997715 0.19079150 0.10275420 1.0 Ni Ni5 1 0.80920850 0.80002285 0.39724580 1.0 Ni Ni6 1 0.80002285 0.80920850 0.89724580 1.0 Ni Ni7 1 0.19079150 0.19997715 0.60275420 1.0 Ni Ni8 1 0.00000000 0.00000000 0.50000000 1.0 Ni Ni9 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni10 1 0.16000102 0.83999898 0.75000000 1.0 Ni Ni11 1 0.83999898 0.16000102 0.25000000 1.0 Sn Sn12 1 0.76670293 0.44933239 0.03440642 1.0 Sn Sn13 1 0.55066761 0.23329707 0.46559358 1.0 Sn Sn14 1 0.23329707 0.55066761 0.96559358 1.0 Sn Sn15 1 0.44933239 0.76670293 0.53440642 1.0 Sn Sn16 1 0.36767447 0.04588281 0.85259169 1.0 Sn Sn17 1 0.95411719 0.63232553 0.64740831 1.0 Sn Sn18 1 0.63232553 0.95411719 0.14740831 1.0 Sn Sn19 1 0.04588281 0.36767447 0.35259169 1.0 Sn Sn20 1 0.80431090 0.19568910 0.75000000 1.0 Sn Sn21 1 0.19568910 0.80431090 0.25000000 1.0