# generated using pymatgen
data_LiHfMg30O31
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.53610800
_cell_length_b   8.55739300
_cell_length_c   8.56941800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiHfMg30O31
_chemical_formula_sum   'Li1 Hf1 Mg30 O31'
_cell_volume   625.96882710
_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
  Li  Li0  1  0.00005200  0.00000000  0.00000000  1
  Hf  Hf1  1  0.98735000  0.50000000  0.00000000  1
  Mg  Mg2  1  0.99982800  0.00000000  0.50000000  1
  Mg  Mg3  1  0.00136100  0.50000000  0.50000000  1
  Mg  Mg4  1  0.49971800  0.00000000  0.00000000  1
  Mg  Mg5  1  0.50006100  0.50000000  0.00000000  1
  Mg  Mg6  1  0.50012000  0.00000000  0.50000000  1
  Mg  Mg7  1  0.49985300  0.50000000  0.50000000  1
  Mg  Mg8  1  0.99991100  0.75773900  0.74644700  1
  Mg  Mg9  1  0.99991100  0.24226100  0.74644700  1
  Mg  Mg10  1  0.99991100  0.75773900  0.25355300  1
  Mg  Mg11  1  0.99991100  0.24226100  0.25355300  1
  Mg  Mg12  1  0.50021700  0.75130400  0.74946300  1
  Mg  Mg13  1  0.50021700  0.24869600  0.74946300  1
  Mg  Mg14  1  0.50021700  0.75130400  0.25053700  1
  Mg  Mg15  1  0.50021700  0.24869600  0.25053700  1
  Mg  Mg16  1  0.74615800  0.75886200  0.00000000  1
  Mg  Mg17  1  0.74615800  0.24113800  0.00000000  1
  Mg  Mg18  1  0.74955100  0.75201100  0.50000000  1
  Mg  Mg19  1  0.74955100  0.24798900  0.50000000  1
  Mg  Mg20  1  0.25241900  0.75674400  0.00000000  1
  Mg  Mg21  1  0.25241900  0.24325600  0.00000000  1
  Mg  Mg22  1  0.25039300  0.75119200  0.50000000  1
  Mg  Mg23  1  0.25039300  0.24880800  0.50000000  1
  Mg  Mg24  1  0.75228400  0.00000000  0.75181700  1
  Mg  Mg25  1  0.74792200  0.50000000  0.74556200  1
  Mg  Mg26  1  0.75228400  0.00000000  0.24818300  1
  Mg  Mg27  1  0.74792200  0.50000000  0.25443800  1
  Mg  Mg28  1  0.24769400  0.00000000  0.75253700  1
  Mg  Mg29  1  0.25298100  0.50000000  0.74707900  1
  Mg  Mg30  1  0.24769400  0.00000000  0.24746300  1
  Mg  Mg31  1  0.25298100  0.50000000  0.25292100  1
  O  O32  1  0.74412300  0.00000000  0.00000000  1
  O  O33  1  0.74923400  0.00000000  0.50000000  1
  O  O34  1  0.75021200  0.50000000  0.50000000  1
  O  O35  1  0.25584600  0.00000000  0.00000000  1
  O  O36  1  0.25053300  0.50000000  0.00000000  1
  O  O37  1  0.25073900  0.00000000  0.50000000  1
  O  O38  1  0.25176300  0.50000000  0.50000000  1
  O  O39  1  0.75033400  0.75179300  0.74837700  1
  O  O40  1  0.75033400  0.24820700  0.74837700  1
  O  O41  1  0.75033400  0.75179300  0.25162300  1
  O  O42  1  0.75033400  0.24820700  0.25162300  1
  O  O43  1  0.24947600  0.74974300  0.75097400  1
  O  O44  1  0.24947600  0.25025700  0.75097400  1
  O  O45  1  0.24947600  0.74974300  0.24902600  1
  O  O46  1  0.24947600  0.25025700  0.24902600  1
  O  O47  1  0.99955300  0.74152000  0.00000000  1
  O  O48  1  0.99955300  0.25848000  0.00000000  1
  O  O49  1  0.00017100  0.74881600  0.50000000  1
  O  O50  1  0.00017100  0.25118400  0.50000000  1
  O  O51  1  0.50002300  0.74840900  0.00000000  1
  O  O52  1  0.50002300  0.25159100  0.00000000  1
  O  O53  1  0.49969400  0.74913100  0.50000000  1
  O  O54  1  0.49969400  0.25086900  0.50000000  1
  O  O55  1  0.00027200  0.00000000  0.74410900  1
  O  O56  1  0.00623700  0.50000000  0.74414100  1
  O  O57  1  0.00027200  0.00000000  0.25589100  1
  O  O58  1  0.00623700  0.50000000  0.25585900  1
  O  O59  1  0.49965500  0.00000000  0.74951400  1
  O  O60  1  0.49971900  0.50000000  0.74960900  1
  O  O61  1  0.49965500  0.00000000  0.25048600  1
  O  O62  1  0.49971900  0.50000000  0.25039100  1
