# generated using pymatgen
data_ThBeGeH
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.98139300
_cell_length_b   3.98139296
_cell_length_c   8.77269946
_cell_angle_alpha   90.00002794
_cell_angle_beta   89.99991860
_cell_angle_gamma   60.00004890
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ThBeGeH
_chemical_formula_sum   'Th2 Be2 Ge2 H2'
_cell_volume   120.42986231
_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  0.00000000  0.00000000  0.49999900  1.0
  Th  Th1  1  0.00000000  0.00000000  0.00000100  1.0
  Be  Be2  1  0.33333300  0.33333400  0.75220151  1.0
  Be  Be3  1  0.66666700  0.66666600  0.24779949  1.0
  Ge  Ge4  1  0.33333400  0.33333300  0.26530693  1.0
  Ge  Ge5  1  0.66666600  0.66666700  0.73469207  1.0
  H  H6  1  0.33333300  0.33333300  0.93415848  1.0
  H  H7  1  0.66666700  0.66666700  0.06584252  1.0