# generated using pymatgen data_Ce(BH4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.95526809 _cell_length_b 6.95526809 _cell_length_c 4.38473899 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce(BH4)2 _chemical_formula_sum 'Ce2 B4 H16' _cell_volume 212.11505536 _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 Ce Ce0 1 0.50000000 0.00000000 0.02051356 1.0 Ce Ce1 1 0.00000000 0.50000000 0.52051356 1.0 B B2 1 0.23453034 0.30651487 0.02331191 1.0 B B3 1 0.76546966 0.69348513 0.02331191 1.0 B B4 1 0.30651487 0.76546966 0.52331191 1.0 B B5 1 0.69348513 0.23453034 0.52331191 1.0 H H6 1 0.15922009 0.46747739 0.02319577 1.0 H H7 1 0.84077991 0.53252261 0.02319577 1.0 H H8 1 0.40716850 0.33666250 0.03592942 1.0 H H9 1 0.59283150 0.66333750 0.03592942 1.0 H H10 1 0.18053337 0.21272699 0.24470163 1.0 H H11 1 0.81946663 0.78727301 0.24470163 1.0 H H12 1 0.22116878 0.80638637 0.28660749 1.0 H H13 1 0.77883122 0.19361363 0.28660749 1.0 H H14 1 0.46747739 0.84077991 0.52319577 1.0 H H15 1 0.53252261 0.15922009 0.52319577 1.0 H H16 1 0.33666250 0.59283150 0.53592942 1.0 H H17 1 0.66333750 0.40716850 0.53592942 1.0 H H18 1 0.21272699 0.81946663 0.74470163 1.0 H H19 1 0.78727301 0.18053337 0.74470163 1.0 H H20 1 0.19361363 0.22116878 0.78660749 1.0 H H21 1 0.80638637 0.77883122 0.78660749 1.0