# generated using pymatgen
data_BeO
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.68522923
_cell_length_b   4.60864522
_cell_length_c   4.60864522
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeO
_chemical_formula_sum   'Be4 O4'
_cell_volume   57.03322366
_cell_formula_units_Z   4
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
  Be  Be0  1  -0.00000000  0.32641998  0.67358002  1.0
  Be  Be1  1  0.50000000  0.82641998  0.82641998  1.0
  Be  Be2  1  0.50000000  0.17358002  0.17358002  1.0
  Be  Be3  1  -0.00000000  0.67358002  0.32641998  1.0
  O  O4  1  0.00000000  0.31135549  0.31135549  1.0
  O  O5  1  0.50000000  0.18864451  0.81135549  1.0
  O  O6  1  0.50000000  0.81135549  0.18864451  1.0
  O  O7  1  0.00000000  0.68864451  0.68864451  1.0