data_image0
_chemical_formula_structural       Be3F6
_chemical_formula_sum              "Be3 F6"
_cell_length_a       4.385315
_cell_length_b       4.385314582340131
_cell_length_c       4.954915
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    119.99999560723508

_space_group_name_H-M_alt    "P 1"
_space_group_IT_number       1

loop_
  _space_group_symop_operation_xyz
  '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  Be1       1.0  0.5582093902000002  0.5582925246  0.0  1.0000
  Be  Be2       1.0  0.441705998  0.0  0.3333558699  1.0000
  Be  Be3       1.0  2.3125847468830566e-17  0.44179068160000007  0.6666895396  1.0000
  F   F1        1.0  0.6079177574  0.9146441329  0.0906312217  1.0000
  F   F2        1.0  0.39207024090000003  0.3068202225000001  0.242712539  1.0000
  F   F3        1.0  0.08535424580000009  0.6932708830000001  0.4239648914  1.0000
  F   F4        1.0  0.6931800544  0.0852494896  0.5760441905  1.0000
  F   F5        1.0  0.3067276792  0.3920802445  0.7572985611  1.0000
  F   F6        1.0  0.914748494  0.6079292347000002  0.9093778602000001  1.0000