# generated using pymatgen data_RbB5(H2O3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.62377101 _cell_length_b 8.62377101 _cell_length_c 13.97249500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 95.63905274 _symmetry_Int_Tables_number 1 _chemical_formula_structural RbB5(H2O3)4 _chemical_formula_sum 'Rb2 B10 H16 O24' _cell_volume 1034.09774862 _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 Rb Rb0 1 0.57932900 0.57932900 0.50000000 1.0 Rb Rb1 1 0.07932900 0.07932900 0.00000000 1.0 B B2 1 0.90615300 0.90615300 0.50000000 1.0 B B3 1 0.40615300 0.40615300 0.00000000 1.0 B B4 1 0.90426700 0.75133900 0.65302600 1.0 B B5 1 0.75133900 0.90426700 0.34697400 1.0 B B6 1 0.40426700 0.25133900 0.84697400 1.0 B B7 1 0.25133900 0.40426700 0.15302600 1.0 B B8 1 0.91543900 0.01513400 0.65268700 1.0 B B9 1 0.01513400 0.91543900 0.34731300 1.0 B B10 1 0.41543900 0.51513400 0.84731300 1.0 B B11 1 0.51513400 0.41543900 0.15268700 1.0 H H12 1 0.49394900 0.93850100 0.49695000 1.0 H H13 1 0.93850100 0.49394900 0.50305000 1.0 H H14 1 0.99394900 0.43850100 0.00305000 1.0 H H15 1 0.43850100 0.99394900 0.99695000 1.0 H H16 1 0.29184300 0.04584400 0.48849700 1.0 H H17 1 0.04584400 0.29184300 0.51150300 1.0 H H18 1 0.79184300 0.54584400 0.01150300 1.0 H H19 1 0.54584400 0.79184300 0.98849700 1.0 H H20 1 0.31096100 0.12434800 0.51130700 1.0 H H21 1 0.12434800 0.31096100 0.48869300 1.0 H H22 1 0.81096100 0.62434800 0.98869300 1.0 H H23 1 0.62434800 0.81096100 0.01130700 1.0 H H24 1 0.89709900 0.62879700 0.69340800 1.0 H H25 1 0.62879700 0.89709900 0.30659200 1.0 H H26 1 0.39709900 0.12879700 0.80659200 1.0 H H27 1 0.12879700 0.39709900 0.19340800 1.0 O O28 1 0.90181700 0.76481900 0.55784900 1.0 O O29 1 0.76481900 0.90181700 0.44215100 1.0 O O30 1 0.40181700 0.26481900 0.94215100 1.0 O O31 1 0.26481900 0.40181700 0.05784900 1.0 O O32 1 0.91811400 0.05001900 0.56329700 1.0 O O33 1 0.05001900 0.91811400 0.43670300 1.0 O O34 1 0.41811400 0.55001900 0.93670300 1.0 O O35 1 0.55001900 0.41811400 0.06329700 1.0 O O36 1 0.90896500 0.89353300 0.71013100 1.0 O O37 1 0.89353300 0.90896500 0.28986900 1.0 O O38 1 0.40896500 0.39353300 0.78986900 1.0 O O39 1 0.39353300 0.40896500 0.21013100 1.0 O O40 1 0.83769100 0.43658400 0.51615100 1.0 O O41 1 0.43658400 0.83769100 0.48384900 1.0 O O42 1 0.33769100 0.93658400 0.98384900 1.0 O O43 1 0.93658400 0.33769100 0.01615100 1.0 O O44 1 0.04009000 0.79998700 0.87525300 1.0 O O45 1 0.79998700 0.04009000 0.12474700 1.0 O O46 1 0.54009000 0.29998700 0.62474700 1.0 O O47 1 0.29998700 0.54009000 0.37525300 1.0 O O48 1 0.57039300 0.17568400 0.58813100 1.0 O O49 1 0.17568400 0.57039300 0.41186900 1.0 O O50 1 0.07039300 0.67568400 0.91186900 1.0 O O51 1 0.67568400 0.07039300 0.08813100 1.0