# generated using pymatgen
data_Th2BeB10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.59497332
_cell_length_b   11.10890141
_cell_length_c   4.16692044
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2BeB10
_chemical_formula_sum   'Th4 Be2 B20'
_cell_volume   258.99080222
_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
  Th  Th0  1  0.70083981  0.13358777  0.50000000  1.0
  Th  Th1  1  0.20084181  0.36641323  0.50000000  1.0
  Th  Th2  1  0.79916019  0.63358677  0.50000000  1.0
  Th  Th3  1  0.29915919  0.86641223  0.50000000  1.0
  Be  Be4  1  0.00000000  0.00000000  0.00000000  1.0
  Be  Be5  1  0.50000100  0.50000000  0.00000000  1.0
  B  B6  1  0.37074851  0.03880742  0.00000000  1.0
  B  B7  1  0.03009223  0.18602055  0.00000000  1.0
  B  B8  1  0.34206532  0.19660928  0.00000000  1.0
  B  B9  1  0.84206432  0.30338972  0.00000000  1.0
  B  B10  1  0.53009223  0.31397945  0.00000000  1.0
  B  B11  1  0.87074751  0.46119158  0.00000000  1.0
  B  B12  1  0.12925249  0.53880842  0.00000000  1.0
  B  B13  1  0.46990877  0.68602055  0.00000000  1.0
  B  B14  1  0.15793568  0.69661028  0.00000000  1.0
  B  B15  1  0.65793568  0.80339072  0.00000000  1.0
  B  B16  1  0.96990777  0.81397945  0.00000000  1.0
  B  B17  1  0.62925249  0.96119258  0.00000000  1.0
  B  B18  1  0.19925203  0.11201231  0.29972469  1.0
  B  B19  1  0.69925103  0.38798869  0.29972469  1.0
  B  B20  1  0.30074897  0.61201131  0.29972469  1.0
  B  B21  1  0.80074897  0.88798769  0.29972469  1.0
  B  B22  1  0.19925203  0.11201231  0.70027531  1.0
  B  B23  1  0.69925103  0.38798869  0.70027531  1.0
  B  B24  1  0.30074897  0.61201131  0.70027531  1.0
  B  B25  1  0.80074897  0.88798769  0.70027531  1.0