# generated using pymatgen
data_YbTh(NiH4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.09605026
_cell_length_b   6.09604927
_cell_length_c   4.79299993
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   144.66884836
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YbTh(NiH4)2
_chemical_formula_sum   'Yb1 Th1 Ni2 H8'
_cell_volume   103.00506440
_cell_formula_units_Z   1
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
  Yb  Yb0  1  0.86872865  0.13127135  0.75000000  1.0
  Th  Th1  1  0.13193538  0.86806462  0.25000000  1.0
  Ni  Ni2  1  0.59428408  0.40571592  0.75000000  1.0
  Ni  Ni3  1  0.40438879  0.59561121  0.25000000  1.0
  H  H4  1  0.08887257  0.91112743  0.75000000  1.0
  H  H5  1  0.91494849  0.08505151  0.25000000  1.0
  H  H6  1  0.69168792  0.30831208  0.50453846  1.0
  H  H7  1  0.30764887  0.69235113  0.49389693  1.0
  H  H8  1  0.69168792  0.30831208  0.99546154  1.0
  H  H9  1  0.30764887  0.69235113  0.00610307  1.0
  H  H10  1  0.49908423  0.50091577  0.99972295  1.0
  H  H11  1  0.49908423  0.50091577  0.50027705  1.0