# generated using pymatgen data_Ti2Ni _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.95037742 _cell_length_b 7.95040108 _cell_length_c 7.95035457 _cell_angle_alpha 60.00236957 _cell_angle_beta 60.00235198 _cell_angle_gamma 60.00253062 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti2Ni _chemical_formula_sum 'Ti16 Ni8' _cell_volume 355.36290054 _cell_formula_units_Z 8 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 Ti Ti0 1 0.12502449 0.62499412 0.62500016 1.0 Ti Ti1 1 0.62499111 0.12502494 0.62500526 1.0 Ti Ti2 1 0.62499307 0.62500268 0.12501913 1.0 Ti Ti3 1 0.62498720 0.62498789 0.62499621 1.0 Ti Ti4 1 0.81333498 0.81333372 0.18665773 1.0 Ti Ti5 1 0.18666696 0.18666651 0.81334227 1.0 Ti Ti6 1 0.81332915 0.18666302 0.81333977 1.0 Ti Ti7 1 0.18667334 0.81333393 0.18666464 1.0 Ti Ti8 1 0.18666135 0.81332988 0.81334227 1.0 Ti Ti9 1 0.81333822 0.18666989 0.18666076 1.0 Ti Ti10 1 0.43661280 0.43662543 0.06337394 1.0 Ti Ti11 1 0.06338361 0.06337185 0.43662248 1.0 Ti Ti12 1 0.43661644 0.06337319 0.43661757 1.0 Ti Ti13 1 0.06338091 0.43662713 0.06337522 1.0 Ti Ti14 1 0.06337556 0.43662566 0.43661492 1.0 Ti Ti15 1 0.43662410 0.06337266 0.06337826 1.0 Ni Ni16 1 0.77330948 0.40889518 0.40890112 1.0 Ni Ni17 1 0.40890054 0.77329408 0.40890316 1.0 Ni Ni18 1 0.40890145 0.40889729 0.77330227 1.0 Ni Ni19 1 0.40889809 0.40890093 0.40890453 1.0 Ni Ni20 1 0.47669662 0.84110658 0.84110194 1.0 Ni Ni21 1 0.84110332 0.47669480 0.84110261 1.0 Ni Ni22 1 0.84110615 0.84110984 0.47668348 1.0 Ni Ni23 1 0.84108903 0.84109579 0.84109032 1.0