# generated using pymatgen
data_LaTh(NiH4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.24291620
_cell_length_b   6.24291594
_cell_length_c   4.83944825
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   143.79260383
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaTh(NiH4)2
_chemical_formula_sum   'La1 Th1 Ni2 H8'
_cell_volume   111.41535305
_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
  La  La0  1  0.86642379  0.13357621  0.75000000  1.0
  Th  Th1  1  0.13171168  0.86828832  0.25000000  1.0
  Ni  Ni2  1  0.59152564  0.40847436  0.75000000  1.0
  Ni  Ni3  1  0.40997766  0.59002234  0.25000000  1.0
  H  H4  1  0.08945818  0.91054182  0.75000000  1.0
  H  H5  1  0.92106022  0.07893978  0.25000000  1.0
  H  H6  1  0.68665814  0.31334186  0.50142336  1.0
  H  H7  1  0.30770999  0.69229001  0.48168107  1.0
  H  H8  1  0.68665814  0.31334186  0.99857664  1.0
  H  H9  1  0.30770999  0.69229001  0.01831893  1.0
  H  H10  1  0.50055329  0.49944671  0.00113826  1.0
  H  H11  1  0.50055329  0.49944671  0.49886174  1.0