# generated using pymatgen
data_CaTm(NiH4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.56007670
_cell_length_b   4.71929608
_cell_length_c   6.02373010
_cell_angle_alpha   90.00000000
_cell_angle_beta   107.19212556
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaTm(NiH4)2
_chemical_formula_sum   'Ca1 Tm1 Ni2 H8'
_cell_volume   96.68308433
_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
  Ca  Ca0  1  0.63434324  0.24999900  0.26833569  1.0
  Tm  Tm1  1  0.36747090  0.75000000  0.73518714  1.0
  Ni  Ni2  1  0.09526165  0.75000000  0.18871033  1.0
  Ni  Ni3  1  0.90233464  0.24999900  0.80545301  1.0
  H  H4  1  0.99883813  0.99713153  0.99800437  1.0
  H  H5  1  0.99883813  0.50286947  0.99800437  1.0
  H  H6  1  0.58050338  0.75000000  0.16062134  1.0
  H  H7  1  0.19409908  0.98092451  0.38815741  1.0
  H  H8  1  0.19409908  0.51907649  0.38815741  1.0
  H  H9  1  0.81321366  0.51064374  0.62653111  1.0
  H  H10  1  0.81321366  0.98935726  0.62653111  1.0
  H  H11  1  0.40778243  0.24999900  0.81630672  1.0