# generated using pymatgen data_Ti6CrSi6Tc5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.48804798 _cell_length_b 7.48800805 _cell_length_c 7.48800709 _cell_angle_alpha 126.46683193 _cell_angle_beta 129.03370647 _cell_angle_gamma 77.04786193 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti6CrSi6Tc5 _chemical_formula_sum 'Ti6 Cr1 Si6 Tc5' _cell_volume 254.58594189 _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 0.45092839 0.40582571 0.45326279 1.0 Ti Ti1 1 0.54907161 0.00233440 0.95489732 1.0 Ti Ti2 1 0.04740132 0.00228686 0.45327596 1.0 Ti Ti3 1 0.95259868 0.40587363 0.95488553 1.0 Ti Ti4 1 0.24997886 0.60188505 0.85182421 1.0 Ti Ti5 1 0.75002114 0.60184634 0.35190619 1.0 Cr Cr6 1 0.50000000 0.26578440 0.76578440 1.0 Si Si7 1 0.16633691 0.66923197 0.50297346 1.0 Si Si8 1 0.83366309 0.33663555 0.50289606 1.0 Si Si9 1 0.66575381 0.66692389 0.00114829 1.0 Si Si10 1 0.33424619 0.33539348 0.00117107 1.0 Si Si11 1 0.25092118 0.00471883 0.25565065 1.0 Si Si12 1 0.74907882 0.00473047 0.75379965 1.0 Tc Tc13 1 0.36960306 0.74351253 0.37391473 1.0 Tc Tc14 1 0.63039694 0.00431267 0.37390947 1.0 Tc Tc15 1 0.86986591 0.74236020 0.87251582 1.0 Tc Tc16 1 0.13013409 0.00264991 0.87249529 1.0 Tc Tc17 1 0.00000000 0.26369012 0.26369012 1.0