# generated using pymatgen data_Mg4Cu11O15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.03443000 _cell_length_b 9.56379200 _cell_length_c 16.28640300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg4Cu11O15 _chemical_formula_sum 'Mg8 Cu22 O30' _cell_volume 628.40189179 _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 Mg Mg0 1 0.00000000 0.50000000 0.28067400 1.0 Mg Mg1 1 0.00000000 0.50000000 0.48079800 1.0 Mg Mg2 1 0.00000000 0.50000000 0.68046400 1.0 Mg Mg3 1 0.00000000 0.50000000 0.88042800 1.0 Mg Mg4 1 0.00000000 0.50000000 0.08056300 1.0 Mg Mg5 1 0.50000000 0.00000000 0.11873200 1.0 Mg Mg6 1 0.50000000 0.00000000 0.31925100 1.0 Mg Mg7 1 0.50000000 0.00000000 0.52035700 1.0 Cu Cu8 1 0.00000000 0.83569300 0.03071900 1.0 Cu Cu9 1 0.00000000 0.83673700 0.22979200 1.0 Cu Cu10 1 0.00000000 0.16430700 0.03071900 1.0 Cu Cu11 1 0.00000000 0.83670800 0.43013100 1.0 Cu Cu12 1 0.00000000 0.16326300 0.22979200 1.0 Cu Cu13 1 0.00000000 0.83639100 0.63088300 1.0 Cu Cu14 1 0.00000000 0.16329200 0.43013100 1.0 Cu Cu15 1 0.00000000 0.83588200 0.83156200 1.0 Cu Cu16 1 0.00000000 0.16360900 0.63088300 1.0 Cu Cu17 1 0.00000000 0.16411800 0.83156200 1.0 Cu Cu18 1 0.50000000 0.33640300 0.16972300 1.0 Cu Cu19 1 0.50000000 0.66359700 0.16972300 1.0 Cu Cu20 1 0.50000000 0.00000000 0.92120900 1.0 Cu Cu21 1 0.50000000 0.00000000 0.72169300 1.0 Cu Cu22 1 0.50000000 0.33671500 0.37010600 1.0 Cu Cu23 1 0.50000000 0.33666300 0.56829000 1.0 Cu Cu24 1 0.50000000 0.66333700 0.56829000 1.0 Cu Cu25 1 0.50000000 0.66328500 0.37010600 1.0 Cu Cu26 1 0.50000000 0.33700900 0.76867700 1.0 Cu Cu27 1 0.50000000 0.33718700 0.96965900 1.0 Cu Cu28 1 0.50000000 0.66299100 0.76867700 1.0 Cu Cu29 1 0.50000000 0.66281300 0.96965900 1.0 O O30 1 0.00000000 0.00000000 0.09668000 1.0 O O31 1 0.00000000 0.00000000 0.29665700 1.0 O O32 1 0.00000000 0.00000000 0.49666600 1.0 O O33 1 0.00000000 0.00000000 0.69607300 1.0 O O34 1 0.00000000 0.34886200 0.18222100 1.0 O O35 1 0.00000000 0.34857600 0.38232600 1.0 O O36 1 0.00000000 0.00000000 0.89628900 1.0 O O37 1 0.00000000 0.34823700 0.58256600 1.0 O O38 1 0.00000000 0.34816700 0.78286200 1.0 O O39 1 0.00000000 0.34895400 0.98222600 1.0 O O40 1 0.00000000 0.65142400 0.38232600 1.0 O O41 1 0.00000000 0.65176300 0.58256600 1.0 O O42 1 0.00000000 0.65113800 0.18222100 1.0 O O43 1 0.00000000 0.65183300 0.78286200 1.0 O O44 1 0.00000000 0.65104600 0.98222600 1.0 O O45 1 0.50000000 0.84625500 0.01912600 1.0 O O46 1 0.50000000 0.84896900 0.21766700 1.0 O O47 1 0.50000000 0.84884600 0.41775200 1.0 O O48 1 0.50000000 0.84633000 0.61691700 1.0 O O49 1 0.50000000 0.15374500 0.01912600 1.0 O O50 1 0.50000000 0.15103100 0.21766700 1.0 O O51 1 0.50000000 0.50000000 0.10298800 1.0 O O52 1 0.50000000 0.84540700 0.81788800 1.0 O O53 1 0.50000000 0.15115400 0.41775200 1.0 O O54 1 0.50000000 0.15367000 0.61691700 1.0 O O55 1 0.50000000 0.50000000 0.30315500 1.0 O O56 1 0.50000000 0.50000000 0.50140100 1.0 O O57 1 0.50000000 0.15459300 0.81788800 1.0 O O58 1 0.50000000 0.50000000 0.70140200 1.0 O O59 1 0.50000000 0.50000000 0.90233900 1.0