# generated using pymatgen data_Ce3TiAl11Tc4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.92863988 _cell_length_b 8.92863893 _cell_length_c 9.66855518 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999986 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce3TiAl11Tc4 _chemical_formula_sum 'Ce6 Ti2 Al22 Tc8' _cell_volume 667.51769081 _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 Ce Ce0 1 0.80682683 0.61365267 0.75167185 1.0 Ce Ce1 1 0.19317317 0.80682683 0.25167185 1.0 Ce Ce2 1 0.61365267 0.80682683 0.25167185 1.0 Ce Ce3 1 0.38634733 0.19317317 0.75167185 1.0 Ce Ce4 1 0.80682683 0.19317317 0.75167185 1.0 Ce Ce5 1 0.19317317 0.38634733 0.25167185 1.0 Ti Ti6 1 0.33333300 0.66666700 0.51346714 1.0 Ti Ti7 1 0.66666700 0.33333300 0.01346714 1.0 Al Al8 1 0.66666700 0.33333300 0.50034178 1.0 Al Al9 1 0.33333300 0.66666700 0.00034178 1.0 Al Al10 1 0.15899199 0.31798397 0.57559494 1.0 Al Al11 1 0.68201603 0.84100801 0.57559494 1.0 Al Al12 1 0.15899199 0.84100801 0.57559494 1.0 Al Al13 1 0.84100801 0.15899199 0.07559494 1.0 Al Al14 1 0.83899689 0.16100311 0.42285734 1.0 Al Al15 1 0.84100801 0.68201603 0.07559494 1.0 Al Al16 1 0.31798397 0.15899199 0.07559494 1.0 Al Al17 1 0.67799478 0.83899689 0.92285734 1.0 Al Al18 1 0.16100311 0.32200522 0.92285734 1.0 Al Al19 1 0.83899689 0.67799478 0.42285734 1.0 Al Al20 1 0.00000000 0.00000000 0.24904447 1.0 Al Al21 1 0.00000000 0.00000000 0.74904447 1.0 Al Al22 1 0.56196792 0.12393584 0.24916607 1.0 Al Al23 1 0.43803208 0.56196792 0.74916607 1.0 Al Al24 1 0.12393584 0.56196792 0.74916607 1.0 Al Al25 1 0.87606416 0.43803208 0.24916607 1.0 Al Al26 1 0.56196792 0.43803208 0.24916607 1.0 Al Al27 1 0.43803208 0.87606416 0.74916607 1.0 Al Al28 1 0.16100311 0.83899689 0.92285734 1.0 Al Al29 1 0.32200522 0.16100311 0.42285734 1.0 Tc Tc30 1 0.00000000 0.00000000 0.49909504 1.0 Tc Tc31 1 0.00000000 0.00000000 0.99909504 1.0 Tc Tc32 1 0.49858545 0.99717190 0.49672665 1.0 Tc Tc33 1 0.50141455 0.49858545 0.99672665 1.0 Tc Tc34 1 0.99717190 0.49858545 0.99672665 1.0 Tc Tc35 1 0.00282810 0.50141455 0.49672665 1.0 Tc Tc36 1 0.49858545 0.50141455 0.49672665 1.0 Tc Tc37 1 0.50141455 0.00282810 0.99672665 1.0