# generated using pymatgen
data_LiMgH6Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.66344300
_cell_length_b   6.66344300
_cell_length_c   6.66344300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMgH6Ir
_chemical_formula_sum   'Li4 Mg4 H24 Ir4'
_cell_volume   295.86668188
_cell_formula_units_Z   4
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
  Li  Li0  1  0.00000000  0.00000000  0.50000000  1
  Li  Li1  1  0.00000000  0.50000000  0.00000000  1
  Li  Li2  1  0.50000000  0.00000000  0.00000000  1
  Li  Li3  1  0.00000000  0.00000000  0.00000000  1
  Mg  Mg4  1  0.50000000  0.50000000  0.50000000  1
  Mg  Mg5  1  0.00000000  0.50000000  0.50000000  1
  Mg  Mg6  1  0.50000000  0.00000000  0.50000000  1
  Mg  Mg7  1  0.50000000  0.50000000  0.00000000  1
  H  H8  1  0.75240900  0.75240900  0.50718900  1
  H  H9  1  0.24759100  0.24759100  0.50718900  1
  H  H10  1  0.00652700  0.75038400  0.75038400  1
  H  H11  1  0.24961600  0.99347300  0.75038400  1
  H  H12  1  0.75038400  0.00652700  0.75038400  1
  H  H13  1  0.99347300  0.24961600  0.75038400  1
  H  H14  1  0.75240900  0.50718900  0.75240900  1
  H  H15  1  0.50718900  0.75240900  0.75240900  1
  H  H16  1  0.49281100  0.24759100  0.75240900  1
  H  H17  1  0.24759100  0.49281100  0.75240900  1
  H  H18  1  0.24961600  0.75038400  0.99347300  1
  H  H19  1  0.75038400  0.24961600  0.99347300  1
  H  H20  1  0.75038400  0.75038400  0.00652700  1
  H  H21  1  0.24961600  0.24961600  0.00652700  1
  H  H22  1  0.24759100  0.50718900  0.24759100  1
  H  H23  1  0.49281100  0.75240900  0.24759100  1
  H  H24  1  0.50718900  0.24759100  0.24759100  1
  H  H25  1  0.75240900  0.49281100  0.24759100  1
  H  H26  1  0.99347300  0.75038400  0.24961600  1
  H  H27  1  0.75038400  0.99347300  0.24961600  1
  H  H28  1  0.24961600  0.00652700  0.24961600  1
  H  H29  1  0.00652700  0.24961600  0.24961600  1
  H  H30  1  0.24759100  0.75240900  0.49281100  1
  H  H31  1  0.75240900  0.24759100  0.49281100  1
  Ir  Ir32  1  0.25679100  0.74320900  0.74320900  1
  Ir  Ir33  1  0.74320900  0.25679100  0.74320900  1
  Ir  Ir34  1  0.74320900  0.74320900  0.25679100  1
  Ir  Ir35  1  0.25679100  0.25679100  0.25679100  1
