# generated using pymatgen
data_CaPr3H10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.70495682
_cell_length_b   6.70495649
_cell_length_c   6.70495517
_cell_angle_alpha   132.26757507
_cell_angle_beta   131.15184029
_cell_angle_gamma   70.69172692
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaPr3H10
_chemical_formula_sum   'Ca1 Pr3 H10'
_cell_volume   164.53385562
_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  0.50557293  0.00557293  0.50000000  1.0
  Pr  Pr1  1  0.23906899  0.23906899  0.00000000  1.0
  Pr  Pr2  1  0.99039861  0.49039861  0.50000000  1.0
  Pr  Pr3  1  0.75886184  0.75886184  1.00000000  1.0
  H  H4  1  0.59771770  0.62441753  0.47148158  1.0
  H  H5  1  0.15293494  0.12623612  0.52851842  1.0
  H  H6  1  0.59771770  0.12623612  0.97330117  1.0
  H  H7  1  0.15293494  0.62441753  0.02669883  1.0
  H  H8  1  0.37733347  0.39764486  0.52722402  1.0
  H  H9  1  0.87042085  0.85010945  0.47277598  1.0
  H  H10  1  0.87042085  0.39764486  0.02031140  1.0
  H  H11  1  0.37733347  0.85010945  0.97968860  1.0
  H  H12  1  0.76009349  0.26009349  0.50000000  1.0
  H  H13  1  0.99919023  0.99919023  0.00000000  1.0