# generated using pymatgen
data_CaPu3H10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.53141283
_cell_length_b   6.53141233
_cell_length_c   6.53141343
_cell_angle_alpha   133.31059693
_cell_angle_beta   131.75396080
_cell_angle_gamma   69.39727424
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaPu3H10
_chemical_formula_sum   'Ca1 Pu3 H10'
_cell_volume   148.39541078
_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  0.50653830  0.00653830  0.50000000  1.0
  Pu  Pu1  1  0.75978913  0.75978913  1.00000000  1.0
  Pu  Pu2  1  0.99037195  0.49037195  0.50000000  1.0
  Pu  Pu3  1  0.23912448  0.23912448  0.00000000  1.0
  H  H4  1  0.37199930  0.40606713  0.52684450  1.0
  H  H5  1  0.87922262  0.84515480  0.47315550  1.0
  H  H6  1  0.60065674  0.13119535  0.98303212  1.0
  H  H7  1  0.14816424  0.61762563  0.01696788  1.0
  H  H8  1  0.37199930  0.84515480  0.96593218  1.0
  H  H9  1  0.87922262  0.40606713  0.03406782  1.0
  H  H10  1  0.60065674  0.61762563  0.46946139  1.0
  H  H11  1  0.14816424  0.13119535  0.53053861  1.0
  H  H12  1  0.75670163  0.25670163  0.50000000  1.0
  H  H13  1  0.99738869  0.99738869  0.00000000  1.0