# generated using pymatgen data_Ba3In2O6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.31682409 _cell_length_b 11.31682409 _cell_length_c 11.31682409 _cell_angle_alpha 158.53736687 _cell_angle_beta 158.53736687 _cell_angle_gamma 30.53569649 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba3In2O6 _chemical_formula_sum 'Ba3 In2 O6' _cell_volume 193.91205190 _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 Ba Ba0 1 0.68286064 0.68286064 0.00000000 1.0 Ba Ba1 1 0.31713936 0.31713936 0.00000000 1.0 Ba Ba2 1 0.50000000 0.50000000 0.00000000 1.0 In In3 1 0.89752362 0.89752362 -0.00000000 1.0 In In4 1 0.10247638 0.10247638 0.00000000 1.0 O O5 1 0.80207069 0.80207069 0.00000000 1.0 O O6 1 0.19792931 0.19792931 -0.00000000 1.0 O O7 1 0.41582147 0.91582147 0.50000000 1.0 O O8 1 0.91582147 0.41582147 0.50000000 1.0 O O9 1 0.58417853 0.08417853 0.50000000 1.0 O O10 1 0.08417853 0.58417853 0.50000000 1.0