# generated using pymatgen data_U4Be51B _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.42251492 _cell_length_b 12.42251492 _cell_length_c 12.42251528 _cell_angle_alpha 33.54594433 _cell_angle_beta 33.54594433 _cell_angle_gamma 33.54594904 _symmetry_Int_Tables_number 1 _chemical_formula_structural U4Be51B _chemical_formula_sum 'U4 Be51 B1' _cell_volume 521.42737409 _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 U U0 1 0.62524700 0.62524700 0.62524700 1.0 U U1 1 0.12469200 0.12469200 0.12469200 1.0 U U2 1 0.37475300 0.37475300 0.37475300 1.0 U U3 1 0.87530800 0.87530800 0.87530800 1.0 Be Be4 1 0.08323300 0.85732300 0.20245400 1.0 Be Be5 1 0.58555700 0.35424700 0.70587500 1.0 Be Be6 1 0.91676700 0.14267700 0.79754600 1.0 Be Be7 1 0.41444300 0.64575300 0.29412500 1.0 Be Be8 1 0.74376400 0.97059300 0.31522100 1.0 Be Be9 1 0.23876000 0.46963500 0.82193400 1.0 Be Be10 1 0.25623600 0.02940700 0.68477900 1.0 Be Be11 1 0.76124000 0.53036500 0.17806600 1.0 Be Be12 1 0.45724000 0.10416100 0.33475400 1.0 Be Be13 1 0.95596200 0.60369900 0.83576100 1.0 Be Be14 1 0.54276000 0.89583900 0.66524600 1.0 Be Be15 1 0.04403800 0.39630100 0.16423900 1.0 Be Be16 1 0.42745000 0.78012200 0.01203000 1.0 Be Be17 1 0.92865200 0.28044400 0.51081600 1.0 Be Be18 1 0.57255000 0.21987800 0.98797000 1.0 Be Be19 1 0.07134800 0.71955600 0.48918400 1.0 Be Be20 1 0.79754600 0.91676700 0.14267700 1.0 Be Be21 1 0.29412500 0.41444300 0.64575300 1.0 Be Be22 1 0.20245400 0.08323300 0.85732300 1.0 Be Be23 1 0.70587500 0.58555700 0.35424700 1.0 Be Be24 1 0.68477900 0.25623600 0.02940700 1.0 Be Be25 1 0.17806600 0.76124000 0.53036500 1.0 Be Be26 1 0.31522100 0.74376400 0.97059300 1.0 Be Be27 1 0.82193400 0.23876000 0.46963500 1.0 Be Be28 1 0.66524600 0.54276000 0.89583900 1.0 Be Be29 1 0.16423900 0.04403800 0.39630100 1.0 Be Be30 1 0.33475400 0.45724000 0.10416100 1.0 Be Be31 1 0.83576100 0.95596200 0.60369900 1.0 Be Be32 1 0.98797000 0.57255000 0.21987800 1.0 Be Be33 1 0.48918400 0.07134800 0.71955600 1.0 Be Be34 1 0.01203000 0.42745000 0.78012200 1.0 Be Be35 1 0.51081600 0.92865200 0.28044400 1.0 Be Be36 1 0.97059300 0.31522100 0.74376400 1.0 Be Be37 1 0.46963500 0.82193400 0.23876000 1.0 Be Be38 1 0.02940700 0.68477900 0.25623600 1.0 Be Be39 1 0.53036500 0.17806600 0.76124000 1.0 Be Be40 1 0.85732300 0.20245400 0.08323300 1.0 Be Be41 1 0.35424700 0.70587500 0.58555700 1.0 Be Be42 1 0.14267700 0.79754600 0.91676700 1.0 Be Be43 1 0.64575300 0.29412500 0.41444300 1.0 Be Be44 1 0.78012200 0.01203000 0.42745000 1.0 Be Be45 1 0.28044400 0.51081600 0.92865200 1.0 Be Be46 1 0.21987800 0.98797000 0.57255000 1.0 Be Be47 1 0.71955600 0.48918400 0.07134800 1.0 Be Be48 1 0.10416100 0.33475400 0.45724000 1.0 Be Be49 1 0.60369900 0.83576100 0.95596200 1.0 Be Be50 1 0.89583900 0.66524600 0.54276000 1.0 Be Be51 1 0.39630100 0.16423900 0.04403800 1.0 Be Be52 1 0.50000000 0.50000000 0.50000000 1.0 Be Be53 1 0.74979800 0.74979800 0.74979800 1.0 Be Be54 1 0.25020200 0.25020200 0.25020200 1.0 B B55 1 0.00000000 0.00000000 0.00000000 1.0