# generated using pymatgen data_CaAc4Zn2Sn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.43983706 _cell_length_b 9.43983654 _cell_length_c 9.43983714 _cell_angle_alpha 124.81737026 _cell_angle_beta 124.81737674 _cell_angle_gamma 81.84074643 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaAc4Zn2Sn _chemical_formula_sum 'Ca2 Ac8 Zn4 Sn2' _cell_volume 545.40922887 _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 Ca Ca0 1 0.00000000 0.00000000 0.00000000 1.0 Ca Ca1 1 0.50000000 0.50000000 0.00000000 1.0 Ac Ac2 1 0.80620397 0.30620397 0.82965746 1.0 Ac Ac3 1 0.19379603 0.69379603 0.17034254 1.0 Ac Ac4 1 0.47654651 0.97654651 0.17034254 1.0 Ac Ac5 1 0.30620397 0.47654651 0.50000000 1.0 Ac Ac6 1 0.02345349 0.19379603 0.50000000 1.0 Ac Ac7 1 0.52345349 0.02345349 0.82965746 1.0 Ac Ac8 1 0.69379603 0.52345349 0.50000000 1.0 Ac Ac9 1 0.97654651 0.80620397 0.50000000 1.0 Zn Zn10 1 0.12910363 0.62910363 0.75820827 1.0 Zn Zn11 1 0.87089637 0.37089637 0.24179173 1.0 Zn Zn12 1 0.62910363 0.87089637 0.50000000 1.0 Zn Zn13 1 0.37089637 0.12910363 0.50000000 1.0 Sn Sn14 1 0.25000000 0.25000000 0.00000000 1.0 Sn Sn15 1 0.75000000 0.75000000 0.00000000 1.0