# generated using pymatgen data_Zr6Al7Cu16H9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.55838914 _cell_length_b 8.55838914 _cell_length_c 8.55838914 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6Al7Cu16H9 _chemical_formula_sum 'Zr6 Al7 Cu16 H9' _cell_volume 443.26260173 _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 Zr Zr0 1 0.20035500 0.79964500 0.20035500 1.0 Zr Zr1 1 0.20035500 0.79964500 0.79964500 1.0 Zr Zr2 1 0.79964500 0.20035500 0.20035500 1.0 Zr Zr3 1 0.79964500 0.79964500 0.20035500 1.0 Zr Zr4 1 0.20035500 0.20035500 0.79964500 1.0 Zr Zr5 1 0.79964500 0.20035500 0.79964500 1.0 Al Al6 1 0.00000000 0.50000000 0.00000000 1.0 Al Al7 1 0.50000000 0.00000000 0.00000000 1.0 Al Al8 1 0.00000000 0.50000000 0.50000000 1.0 Al Al9 1 0.50000000 0.00000000 0.50000000 1.0 Al Al10 1 0.00000000 0.00000000 0.50000000 1.0 Al Al11 1 0.50000000 0.50000000 0.00000000 1.0 Al Al12 1 0.50000000 0.50000000 0.50000000 1.0 Cu Cu13 1 0.17531600 0.17531600 0.17531600 1.0 Cu Cu14 1 0.52594900 0.82468400 0.82468400 1.0 Cu Cu15 1 0.82468400 0.52594900 0.82468400 1.0 Cu Cu16 1 0.82468400 0.82468400 0.52594900 1.0 Cu Cu17 1 0.17531600 0.47405100 0.17531600 1.0 Cu Cu18 1 0.17531600 0.17531600 0.47405100 1.0 Cu Cu19 1 0.47405100 0.17531600 0.17531600 1.0 Cu Cu20 1 0.82468400 0.82468400 0.82468400 1.0 Cu Cu21 1 0.38071200 0.38071200 0.38071200 1.0 Cu Cu22 1 0.14213600 0.61928800 0.61928800 1.0 Cu Cu23 1 0.61928800 0.14213600 0.61928800 1.0 Cu Cu24 1 0.61928800 0.61928800 0.14213600 1.0 Cu Cu25 1 0.38071200 0.85786400 0.38071200 1.0 Cu Cu26 1 0.38071200 0.38071200 0.85786400 1.0 Cu Cu27 1 0.85786400 0.38071200 0.38071200 1.0 Cu Cu28 1 0.61928800 0.61928800 0.61928800 1.0 H H29 1 0.00000000 0.00000000 0.00000000 1.0 H H30 1 0.09367400 0.09367400 0.09367400 1.0 H H31 1 0.28102300 0.90632600 0.90632600 1.0 H H32 1 0.90632600 0.28102300 0.90632600 1.0 H H33 1 0.90632600 0.90632600 0.28102300 1.0 H H34 1 0.09367400 0.71897700 0.09367400 1.0 H H35 1 0.09367400 0.09367400 0.71897700 1.0 H H36 1 0.71897700 0.09367400 0.09367400 1.0 H H37 1 0.90632600 0.90632600 0.90632600 1.0