# generated using pymatgen data_Ti7Tc5As6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.55644308 _cell_length_b 7.54800700 _cell_length_c 7.54800714 _cell_angle_alpha 127.29799801 _cell_angle_beta 124.43829587 _cell_angle_gamma 80.10060558 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti7Tc5As6 _chemical_formula_sum 'Ti7 Tc5 As6' _cell_volume 272.71006954 _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 Ti Ti0 1 0.46286253 0.24412853 0.27700959 1.0 Ti Ti1 1 0.53713747 0.81414806 0.78126600 1.0 Ti Ti2 1 0.74801346 0.65337806 0.40318119 1.0 Ti Ti3 1 0.25198654 0.65516873 0.90536360 1.0 Ti Ti4 1 0.04908663 0.84968332 0.29193048 1.0 Ti Ti5 1 0.95091337 0.24284385 0.80059669 1.0 Ti Ti6 1 0.50000000 0.99722020 0.49722020 1.0 Tc Tc7 1 0.66732333 0.50394370 0.91519426 1.0 Tc Tc8 1 0.33267667 0.24787192 0.83662237 1.0 Tc Tc9 1 0.90585006 0.24408212 0.40573315 1.0 Tc Tc10 1 0.09414994 0.49988209 0.33823306 1.0 Tc Tc11 1 1.00000000 0.99115653 0.99115653 1.0 As As12 1 0.83371854 0.57550709 0.74525340 1.0 As As13 1 0.16628146 0.91153285 0.74178854 1.0 As As14 1 0.66984819 0.91479088 0.25274112 1.0 As As15 1 0.33015181 0.58289193 0.24494269 1.0 As As16 1 0.27682538 0.28446998 0.50452156 1.0 As As17 1 0.72317462 0.22769618 0.00764560 1.0