# generated using pymatgen data_La8Cu3O16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.53639700 _cell_length_b 8.85995854 _cell_length_c 11.61591289 _cell_angle_alpha 93.66295195 _cell_angle_beta 99.16646330 _cell_angle_gamma 102.40535604 _symmetry_Int_Tables_number 1 _chemical_formula_structural La8Cu3O16 _chemical_formula_sum 'La16 Cu6 O32' _cell_volume 743.95536915 _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 La La0 1 0.81301000 0.04738700 0.72505800 1.0 La La1 1 0.67491200 0.94841000 0.27655300 1.0 La La2 1 0.32508800 0.05159000 0.72344700 1.0 La La3 1 0.82459800 0.79661000 0.98186500 1.0 La La4 1 0.80945400 0.29645600 0.48132600 1.0 La La5 1 0.82878900 0.54936800 0.22568100 1.0 La La6 1 0.31341300 0.79442000 0.98332800 1.0 La La7 1 0.32999100 0.29358400 0.48414800 1.0 La La8 1 0.18699000 0.95261300 0.27494200 1.0 La La9 1 0.67000900 0.70641600 0.51585200 1.0 La La10 1 0.68658700 0.20558000 0.01667200 1.0 La La11 1 0.69222400 0.45057800 0.77763700 1.0 La La12 1 0.19054600 0.70354400 0.51867400 1.0 La La13 1 0.17540200 0.20339000 0.01813500 1.0 La La14 1 0.30777600 0.54942200 0.22236300 1.0 La La15 1 0.17121100 0.45063200 0.77431900 1.0 Cu Cu16 1 0.00000000 0.00000000 0.50000000 1.0 Cu Cu17 1 0.99977100 0.24936900 0.25000600 1.0 Cu Cu18 1 0.49994800 0.24991300 0.24961700 1.0 Cu Cu19 1 0.00022900 0.75063100 0.74999400 1.0 Cu Cu20 1 0.50000000 0.50000000 0.00000000 1.0 Cu Cu21 1 0.50005200 0.75008700 0.75038300 1.0 O O22 1 0.99861800 0.87024500 0.62205300 1.0 O O23 1 0.89927200 0.77495400 0.35743900 1.0 O O24 1 0.50073900 0.87501200 0.62945900 1.0 O O25 1 0.75880400 0.00298000 0.50164700 1.0 O O26 1 0.41497000 0.76264000 0.36419000 1.0 O O27 1 0.91829300 0.01796600 0.11698000 1.0 O O28 1 0.91755500 0.51601200 0.61902300 1.0 O O29 1 0.58503000 0.23736000 0.63581000 1.0 O O30 1 0.99797500 0.36790100 0.12530700 1.0 O O31 1 0.49926100 0.12498800 0.37054100 1.0 O O32 1 0.24119600 0.99702000 0.49835300 1.0 O O33 1 0.74837000 0.24587200 0.24754300 1.0 O O34 1 0.74858800 0.74642800 0.74783200 1.0 O O35 1 0.10072800 0.22504600 0.64256100 1.0 O O36 1 0.60108800 0.97446500 0.89047400 1.0 O O37 1 0.59986200 0.47271100 0.39229600 1.0 O O38 1 0.89776000 0.27108100 0.85566300 1.0 O O39 1 0.40013800 0.52728900 0.60770400 1.0 O O40 1 0.39891200 0.02553500 0.10952600 1.0 O O41 1 0.50195600 0.37852500 0.12704700 1.0 O O42 1 0.25141200 0.25357200 0.25216800 1.0 O O43 1 0.74396200 0.50393400 0.00242100 1.0 O O44 1 0.25163000 0.75412800 0.75245700 1.0 O O45 1 0.00138200 0.12975500 0.37794700 1.0 O O46 1 0.41781000 0.26580900 0.86644300 1.0 O O47 1 0.08170700 0.98203400 0.88302000 1.0 O O48 1 0.08244500 0.48398800 0.38097700 1.0 O O49 1 0.58219000 0.73419100 0.13355700 1.0 O O50 1 0.25603800 0.49606600 0.99757900 1.0 O O51 1 0.49804400 0.62147500 0.87295300 1.0 O O52 1 0.10224000 0.72891900 0.14433700 1.0 O O53 1 0.00202500 0.63209900 0.87469300 1.0