# generated using pymatgen data_Ca2Al2ZnAu9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.60448774 _cell_length_b 5.60448718 _cell_length_c 9.87057401 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 123.05130238 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca2Al2ZnAu9 _chemical_formula_sum 'Ca2 Al2 Zn1 Au9' _cell_volume 259.86801908 _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 Ca Ca0 1 0.00000000 0.50000000 0.75757261 1.0 Ca Ca1 1 0.50000000 0.00000000 0.24242739 1.0 Al Al2 1 0.00000000 0.00000000 0.50000000 1.0 Al Al3 1 0.00000000 0.00000000 0.00000000 1.0 Zn Zn4 1 0.50000000 0.50000000 0.50000000 1.0 Au Au5 1 0.00000000 0.50000000 0.05671316 1.0 Au Au6 1 0.50000000 0.00000000 0.54180794 1.0 Au Au7 1 0.50000000 0.00000000 0.94328684 1.0 Au Au8 1 0.00000000 0.50000000 0.45819206 1.0 Au Au9 1 0.70536418 0.80349035 0.74013227 1.0 Au Au10 1 0.19650965 0.29463582 0.25986773 1.0 Au Au11 1 0.80349035 0.70536418 0.25986773 1.0 Au Au12 1 0.29463582 0.19650965 0.74013227 1.0 Au Au13 1 0.50000000 0.50000000 0.00000000 1.0