# generated using pymatgen data_BH _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.11935317 _cell_length_b 7.11935317 _cell_length_c 10.82884391 _cell_angle_alpha 89.73188219 _cell_angle_beta 89.73188219 _cell_angle_gamma 117.91767792 _symmetry_Int_Tables_number 1 _chemical_formula_structural BH _chemical_formula_sum 'B24 H24' _cell_volume 484.96614214 _cell_formula_units_Z 24 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 B B0 1 0.81627100 0.16668500 0.59446500 1.0 B B1 1 0.83331500 0.18372900 0.90553500 1.0 B B2 1 0.18372900 0.83331500 0.40553500 1.0 B B3 1 0.16668500 0.81627100 0.09446500 1.0 B B4 1 0.87803000 0.98935000 0.68236700 1.0 B B5 1 0.01065000 0.12197000 0.81763300 1.0 B B6 1 0.12197000 0.01065000 0.31763300 1.0 B B7 1 0.98935000 0.87803000 0.18236700 1.0 B B8 1 0.63711000 0.22479500 0.68285100 1.0 B B9 1 0.77520500 0.36289000 0.81714900 1.0 B B10 1 0.36289000 0.77520500 0.31714900 1.0 B B11 1 0.22479500 0.63711000 0.18285100 1.0 B B12 1 0.73696600 0.94142400 0.82425800 1.0 B B13 1 0.05857600 0.26303400 0.67574200 1.0 B B14 1 0.26303400 0.05857600 0.17574200 1.0 B B15 1 0.94142400 0.73696600 0.32425800 1.0 B B16 1 0.59144800 0.08668300 0.82379400 1.0 B B17 1 0.91331700 0.40855200 0.67620600 1.0 B B18 1 0.40855200 0.91331700 0.17620600 1.0 B B19 1 0.08668300 0.59144800 0.32379400 1.0 B B20 1 0.60904200 0.96139900 0.68544500 1.0 B B21 1 0.03860100 0.39095800 0.81455500 1.0 B B22 1 0.39095800 0.03860100 0.31455500 1.0 B B23 1 0.96139900 0.60904200 0.18544500 1.0 H H24 1 0.85525400 0.90481300 0.12973800 1.0 H H25 1 0.09518700 0.14474600 0.37026200 1.0 H H26 1 0.14474600 0.09518700 0.87026200 1.0 H H27 1 0.90481300 0.85525400 0.62973800 1.0 H H28 1 0.50572700 0.26067200 0.63241700 1.0 H H29 1 0.73932800 0.49427300 0.86758300 1.0 H H30 1 0.49427300 0.73932800 0.36758300 1.0 H H31 1 0.26067200 0.50572700 0.13241700 1.0 H H32 1 0.66564100 0.76807800 0.87520600 1.0 H H33 1 0.23192200 0.33435900 0.62479400 1.0 H H34 1 0.33435900 0.23192200 0.12479400 1.0 H H35 1 0.76807800 0.66564100 0.37520600 1.0 H H36 1 0.43058900 0.03180900 0.88558700 1.0 H H37 1 0.96819100 0.56941100 0.61441300 1.0 H H38 1 0.56941100 0.96819100 0.11441300 1.0 H H39 1 0.03180900 0.43058900 0.38558700 1.0 H H40 1 0.46487000 0.81232100 0.63868800 1.0 H H41 1 0.18767900 0.53513000 0.86131200 1.0 H H42 1 0.53513000 0.18767900 0.36131200 1.0 H H43 1 0.81232100 0.46487000 0.13868800 1.0 H H44 1 0.19125700 0.84425800 0.51719400 1.0 H H45 1 0.15574200 0.80874300 0.98280600 1.0 H H46 1 0.80874300 0.15574200 0.48280600 1.0 H H47 1 0.84425800 0.19125700 0.01719400 1.0