# generated using pymatgen data_BaZn2Cu2As3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.71408199 _cell_length_b 6.71408199 _cell_length_c 12.18305600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 143.45719820 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaZn2Cu2As3 _chemical_formula_sum 'Ba2 Zn4 Cu4 As6' _cell_volume 327.00562365 _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 Ba Ba0 1 0.18407600 0.81592400 0.25000000 1.0 Ba Ba1 1 0.81592400 0.18407600 0.75000000 1.0 Zn Zn2 1 0.83264300 0.16735700 0.05837200 1.0 Zn Zn3 1 0.16735700 0.83264300 0.94162800 1.0 Zn Zn4 1 0.16735700 0.83264300 0.55837200 1.0 Zn Zn5 1 0.83264300 0.16735700 0.44162800 1.0 Cu Cu6 1 0.45802600 0.54197400 0.14386400 1.0 Cu Cu7 1 0.54197400 0.45802600 0.85613600 1.0 Cu Cu8 1 0.54197400 0.45802600 0.64386400 1.0 Cu Cu9 1 0.45802600 0.54197400 0.35613600 1.0 As As10 1 0.62524100 0.37475900 0.04560800 1.0 As As11 1 0.37475900 0.62524100 0.95439200 1.0 As As12 1 0.37475900 0.62524100 0.54560800 1.0 As As13 1 0.62524100 0.37475900 0.45439200 1.0 As As14 1 0.91092900 0.08907100 0.25000000 1.0 As As15 1 0.08907100 0.91092900 0.75000000 1.0