# generated using pymatgen data_Ho4BeB14 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.18193988 _cell_length_b 7.18193988 _cell_length_c 7.37010061 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho4BeB14 _chemical_formula_sum 'Ho8 Be2 B28' _cell_volume 380.15170909 _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 Ho Ho0 1 0.19449979 0.32888049 0.00000000 1.0 Ho Ho1 1 0.67111951 0.19449979 0.00000000 1.0 Ho Ho2 1 0.32888049 0.80550021 0.00000000 1.0 Ho Ho3 1 0.69449979 0.17111951 0.50000000 1.0 Ho Ho4 1 0.30550021 0.82888049 0.50000000 1.0 Ho Ho5 1 0.80550021 0.67111951 0.00000000 1.0 Ho Ho6 1 0.82888049 0.69449979 0.50000000 1.0 Ho Ho7 1 0.17111951 0.30550021 0.50000000 1.0 Be Be8 1 0.00000000 0.00000000 0.00000000 1.0 Be Be9 1 0.50000000 0.50000000 0.50000000 1.0 B B10 1 0.17405946 0.03880706 0.22779188 1.0 B B11 1 0.96119294 0.17405946 0.22779188 1.0 B B12 1 0.03880706 0.82594054 0.22779188 1.0 B B13 1 0.67405946 0.46119294 0.27220812 1.0 B B14 1 0.32594054 0.53880706 0.27220812 1.0 B B15 1 0.82594054 0.96119294 0.22779188 1.0 B B16 1 0.53880706 0.67405946 0.27220812 1.0 B B17 1 0.46119294 0.32594054 0.27220812 1.0 B B18 1 0.82594054 0.96119294 0.77220812 1.0 B B19 1 0.03880706 0.82594054 0.77220812 1.0 B B20 1 0.96119294 0.17405946 0.77220812 1.0 B B21 1 0.32594054 0.53880706 0.72779188 1.0 B B22 1 0.67405946 0.46119294 0.72779188 1.0 B B23 1 0.17405946 0.03880706 0.77220812 1.0 B B24 1 0.46119294 0.32594054 0.72779188 1.0 B B25 1 0.53880706 0.67405946 0.72779188 1.0 B B26 1 0.08846615 0.58846615 0.25000000 1.0 B B27 1 0.41153385 0.08846615 0.25000000 1.0 B B28 1 0.58846615 0.91153385 0.25000000 1.0 B B29 1 0.91153385 0.41153385 0.25000000 1.0 B B30 1 0.91153385 0.41153385 0.75000000 1.0 B B31 1 0.58846615 0.91153385 0.75000000 1.0 B B32 1 0.41153385 0.08846615 0.75000000 1.0 B B33 1 0.08846615 0.58846615 0.75000000 1.0 B B34 1 0.00000000 0.00000000 0.38781478 1.0 B B35 1 0.50000000 0.50000000 0.11218522 1.0 B B36 1 0.00000000 0.00000000 0.61218522 1.0 B B37 1 0.50000000 0.50000000 0.88781478 1.0