# generated using pymatgen data_Li5Cu4(BO3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.16024000 _cell_length_b 5.16929434 _cell_length_c 10.26588308 _cell_angle_alpha 89.96394474 _cell_angle_beta 91.62323094 _cell_angle_gamma 119.75246186 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Cu4(BO3)4 _chemical_formula_sum 'Li5 Cu4 B4 O12' _cell_volume 237.61819438 _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 Li Li0 1 0.33577700 0.29955800 0.33202000 1.0 Li Li1 1 0.33730600 0.33272300 0.92292200 1.0 Li Li2 1 0.68828300 0.66239400 0.15336600 1.0 Li Li3 1 0.65360400 0.63085900 0.52734900 1.0 Li Li4 1 0.62840100 0.66893700 0.71708800 1.0 Cu Cu5 1 0.32178500 0.99663300 0.62820600 1.0 Cu Cu6 1 0.97503700 0.32581300 0.12727600 1.0 Cu Cu7 1 0.03206400 0.67953400 0.88387100 1.0 Cu Cu8 1 0.67668200 0.03674000 0.36836800 1.0 B B9 1 0.65753200 0.01038900 0.88501800 1.0 B B10 1 0.99535000 0.33581300 0.62379400 1.0 B B11 1 0.01800300 0.66137400 0.36643800 1.0 B B12 1 0.34042300 0.99537700 0.12714000 1.0 O O13 1 0.74954000 0.05273900 0.59268600 1.0 O O14 1 0.91900000 0.26363600 0.92700500 1.0 O O15 1 0.41617200 0.04154100 0.83628000 1.0 O O16 1 0.94398600 0.57227300 0.65513200 1.0 O O17 1 0.35705300 0.26771400 0.12760600 1.0 O O18 1 0.28157500 0.38073900 0.62114000 1.0 O O19 1 0.74264400 0.64132900 0.35491500 1.0 O O20 1 0.63982100 0.73835000 0.89018200 1.0 O O21 1 0.04868100 0.41960100 0.32705300 1.0 O O22 1 0.58440400 0.96617000 0.16776100 1.0 O O23 1 0.07859200 0.74399300 0.08744900 1.0 O O24 1 0.26368500 0.91917000 0.41713900 1.0