# generated using pymatgen data_Ac4FeTc3I2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.27326975 _cell_length_b 4.27326998 _cell_length_c 19.48511968 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00001361 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ac4FeTc3I2 _chemical_formula_sum 'Ac4 Fe1 Tc3 I2' _cell_volume 308.14440690 _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 Ac Ac0 1 0.00000000 0.00000000 0.11342596 1.0 Ac Ac1 1 0.00000000 0.00000000 0.60575775 1.0 Ac Ac2 1 0.00000000 0.00000000 0.88616883 1.0 Ac Ac3 1 0.00000000 0.00000000 0.39481124 1.0 Fe Fe4 1 0.66666700 0.33333300 0.50242140 1.0 Tc Tc5 1 0.66666700 0.33333300 0.98906893 1.0 Tc Tc6 1 0.33333300 0.66666700 0.49809670 1.0 Tc Tc7 1 0.33333300 0.66666700 0.01034770 1.0 I I8 1 0.66666700 0.33333300 0.25100684 1.0 I I9 1 0.33333300 0.66666700 0.74889366 1.0