# generated using pymatgen
data_PaCr3(NiH6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.69430520
_cell_length_b   5.67487402
_cell_length_c   4.34930656
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.62236429
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PaCr3(NiH6)2
_chemical_formula_sum   'Pa1 Cr3 Ni2 H12'
_cell_volume   122.17650439
_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
  Pa  Pa0  1  0.00000000  0.00000000  0.00000000  1.0
  Cr  Cr1  1  0.50000000  0.00000000  0.50000000  1.0
  Cr  Cr2  1  0.00000000  0.50000000  0.50000000  1.0
  Cr  Cr3  1  0.50000000  0.50000000  0.50000000  1.0
  Ni  Ni4  1  0.66665615  0.33330948  0.00000000  1.0
  Ni  Ni5  1  0.33334385  0.66669052  0.00000000  1.0
  H  H6  1  0.79243947  0.58480312  0.73996713  1.0
  H  H7  1  0.20756053  0.41519688  0.26003287  1.0
  H  H8  1  0.20803428  0.79203855  0.26067401  1.0
  H  H9  1  0.79196572  0.20796145  0.26067401  1.0
  H  H10  1  0.58544498  0.79280439  0.25953281  1.0
  H  H11  1  0.41455502  0.20719561  0.25953281  1.0
  H  H12  1  0.41455502  0.20719561  0.74046719  1.0
  H  H13  1  0.20756053  0.41519688  0.73996713  1.0
  H  H14  1  0.79196572  0.20796145  0.73932599  1.0
  H  H15  1  0.58544498  0.79280439  0.74046719  1.0
  H  H16  1  0.79243947  0.58480312  0.26003287  1.0
  H  H17  1  0.20803428  0.79203855  0.73932599  1.0