# generated using pymatgen
data_Be2Cr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.31335148
_cell_length_b   4.31335078
_cell_length_c   7.09951696
_cell_angle_alpha   90.00000444
_cell_angle_beta   89.99997648
_cell_angle_gamma   119.99944678
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2Cr
_chemical_formula_sum   'Be8 Cr4'
_cell_volume   114.39090100
_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  -0.00000000  -0.00000046  1.0
  Be  Be1  1  0.00000000  -0.00000000  0.50000411  1.0
  Be  Be2  1  0.83164331  0.66328162  0.25004963  1.0
  Be  Be3  1  0.16835952  0.83164148  0.74993769  1.0
  Be  Be4  1  0.66328596  0.83164448  0.74993869  1.0
  Be  Be5  1  0.33671738  0.16835569  0.25004863  1.0
  Be  Be6  1  0.83164031  0.16836069  0.25004963  1.0
  Be  Be7  1  0.16835552  0.33671404  0.74993769  1.0
  Cr  Cr8  1  0.33333500  0.66666600  0.06442068  1.0
  Cr  Cr9  1  0.66666600  0.33333400  0.56449818  1.0
  Cr  Cr10  1  0.66666600  0.33333400  0.93554738  1.0
  Cr  Cr11  1  0.33333400  0.66666600  0.43556716  1.0