# generated using pymatgen data_Cu2O3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.96511157 _cell_length_b 7.96511157 _cell_length_c 7.96511157 _cell_angle_alpha 109.47195010 _cell_angle_beta 109.47126046 _cell_angle_gamma 109.47045134 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu2O3 _chemical_formula_sum 'Cu16 O24' _cell_volume 389.00367117 _cell_formula_units_Z 8 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 Cu Cu0 1 0.50000000 0.00000000 0.00000000 1.0 Cu Cu1 1 0.96609748 0.25000000 0.21609748 1.0 Cu Cu2 1 0.78390245 0.03390245 0.75000000 1.0 Cu Cu3 1 0.71609755 0.46609755 0.25000000 1.0 Cu Cu4 1 0.75000000 0.78389891 0.03389891 1.0 Cu Cu5 1 0.75000000 0.28389891 0.53389891 1.0 Cu Cu6 1 0.46609748 0.25000000 0.71609748 1.0 Cu Cu7 1 0.00000000 0.50000000 0.00000000 1.0 Cu Cu8 1 0.00000000 0.00000000 0.50000000 1.0 Cu Cu9 1 0.53390252 0.75000000 0.28390252 1.0 Cu Cu10 1 0.50000000 0.50000000 0.50000000 1.0 Cu Cu11 1 0.25000000 0.71610109 0.46610109 1.0 Cu Cu12 1 0.25000000 0.21610109 0.96610109 1.0 Cu Cu13 1 0.21609755 0.96609755 0.25000000 1.0 Cu Cu14 1 0.28390245 0.53390245 0.75000000 1.0 Cu Cu15 1 0.03390252 0.75000000 0.78390252 1.0 O O16 1 0.78825883 0.06271134 0.51990446 1.0 O O17 1 0.71174117 0.23164463 0.27445250 1.0 O O18 1 0.26836591 0.98009831 0.04280380 1.0 O O19 1 0.93729551 0.48009831 0.21173340 1.0 O O20 1 0.76836591 0.72556311 0.28826660 1.0 O O21 1 0.43729551 0.22556311 0.45719620 1.0 O O22 1 0.04280687 0.26835537 0.98009554 1.0 O O23 1 0.45719313 0.43728866 0.22554750 1.0 O O24 1 0.98008033 0.04279456 0.26833942 1.0 O O25 1 0.77445714 0.54279456 0.56271523 1.0 O O26 1 0.51991967 0.78825709 0.06271523 1.0 O O27 1 0.72554286 0.28825709 0.76833942 1.0 O O28 1 0.27445714 0.71174291 0.23166058 1.0 O O29 1 0.22554286 0.45720544 0.43728477 1.0 O O30 1 0.48008033 0.21174291 0.93728477 1.0 O O31 1 0.01991967 0.95720544 0.73166058 1.0 O O32 1 0.95719313 0.73164463 0.01990446 1.0 O O33 1 0.54280687 0.56271134 0.77445250 1.0 O O34 1 0.56270449 0.77443689 0.54280380 1.0 O O35 1 0.23163409 0.27443689 0.71173340 1.0 O O36 1 0.06270449 0.51990169 0.78826660 1.0 O O37 1 0.73163409 0.01990169 0.95719620 1.0 O O38 1 0.21174117 0.93728866 0.48009554 1.0 O O39 1 0.28825883 0.76835537 0.72554750 1.0