# generated using pymatgen data_ZrTi(SiTc)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.32902751 _cell_length_b 6.87343468 _cell_length_c 11.90820252 _cell_angle_alpha 89.97804124 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrTi(SiTc)2 _chemical_formula_sum 'Zr3 Ti3 Si6 Tc6' _cell_volume 272.48172102 _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 Zr Zr0 1 0.50000000 0.29949368 0.29783059 1.0 Zr Zr1 1 0.50000000 0.29636340 0.70299121 1.0 Zr Zr2 1 0.50000000 0.79999173 0.20134179 1.0 Ti Ti3 1 0.50000000 0.40150711 0.99770946 1.0 Ti Ti4 1 0.50000000 0.90257290 0.50223840 1.0 Ti Ti5 1 0.50000000 0.79764363 0.79847699 1.0 Si Si6 1 0.50000000 0.00150774 0.99644224 1.0 Si Si7 1 0.50000000 0.50428339 0.50161389 1.0 Si Si8 1 0.00000000 0.98987171 0.66680054 1.0 Si Si9 1 0.00000000 0.49739996 0.15836551 1.0 Si Si10 1 0.00000000 0.50653093 0.83693830 1.0 Si Si11 1 0.00000000 0.99681777 0.34081022 1.0 Tc Tc12 1 0.00000000 0.24158407 0.50214270 1.0 Tc Tc13 1 0.00000000 0.74256014 0.99589180 1.0 Tc Tc14 1 0.00000000 0.63247774 0.63025851 1.0 Tc Tc15 1 0.00000000 0.13049779 0.12432610 1.0 Tc Tc16 1 0.00000000 0.12819037 0.87109954 1.0 Tc Tc17 1 0.00000000 0.63090194 0.37472220 1.0