# generated using pymatgen data_Ac10Sn6AsBr _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.99346623 _cell_length_b 9.99346492 _cell_length_c 7.54187407 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000107 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ac10Sn6AsBr _chemical_formula_sum 'Ac10 Sn6 As1 Br1' _cell_volume 652.29213965 _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 0.25523846 0.25523846 0.76397339 1.0 Ac Ac1 1 0.00000000 0.74476154 0.76397339 1.0 Ac Ac2 1 0.74476154 0.00000000 0.76397339 1.0 Ac Ac3 1 1.00000000 0.25523846 0.23602661 1.0 Ac Ac4 1 0.33333300 0.66666700 0.50000000 1.0 Ac Ac5 1 0.74476154 0.74476154 0.23602661 1.0 Ac Ac6 1 0.66666700 0.33333300 0.50000000 1.0 Ac Ac7 1 0.25523846 0.00000000 0.23602661 1.0 Ac Ac8 1 0.33333300 0.66666700 0.00000000 1.0 Ac Ac9 1 0.66666700 0.33333300 0.00000000 1.0 Sn Sn10 1 0.60761752 0.00000000 0.24951889 1.0 Sn Sn11 1 0.00000000 0.39238248 0.75048111 1.0 Sn Sn12 1 0.39238248 1.00000000 0.75048111 1.0 Sn Sn13 1 0.60761752 0.60761752 0.75048111 1.0 Sn Sn14 1 1.00000000 0.60761752 0.24951889 1.0 Sn Sn15 1 0.39238248 0.39238248 0.24951889 1.0 As As16 1 0.00000000 0.00000000 0.00000000 1.0 Br Br17 1 0.00000000 0.00000000 0.50000000 1.0