# generated using pymatgen
data_LiHfMg30O31
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.54966800
_cell_length_b   8.56013200
_cell_length_c   8.56422000
_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   626.78345974
_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  0.00000000  0.00805500  0.00000000  1
  Hf  Hf1  1  0.50000000  0.99982500  0.00000000  1
  Mg  Mg2  1  0.00000000  0.00032700  0.50000000  1
  Mg  Mg3  1  0.50000000  0.00005700  0.50000000  1
  Mg  Mg4  1  0.00000000  0.49980400  0.00000000  1
  Mg  Mg5  1  0.50000000  0.49971700  0.00000000  1
  Mg  Mg6  1  0.00000000  0.49931000  0.50000000  1
  Mg  Mg7  1  0.50000000  0.49967000  0.50000000  1
  Mg  Mg8  1  0.24176400  0.99972700  0.25326300  1
  Mg  Mg9  1  0.75823600  0.99972700  0.25326300  1
  Mg  Mg10  1  0.24176400  0.99972700  0.74673700  1
  Mg  Mg11  1  0.75823600  0.99972700  0.74673700  1
  Mg  Mg12  1  0.24849800  0.49988200  0.25046900  1
  Mg  Mg13  1  0.75150200  0.49988200  0.25046900  1
  Mg  Mg14  1  0.24849800  0.49988200  0.74953100  1
  Mg  Mg15  1  0.75150200  0.49988200  0.74953100  1
  Mg  Mg16  1  0.24184300  0.74607100  0.00000000  1
  Mg  Mg17  1  0.75815700  0.74607100  0.00000000  1
  Mg  Mg18  1  0.24919800  0.74933800  0.50000000  1
  Mg  Mg19  1  0.75080200  0.74933800  0.50000000  1
  Mg  Mg20  1  0.24226300  0.25317600  0.00000000  1
  Mg  Mg21  1  0.75773700  0.25317600  0.00000000  1
  Mg  Mg22  1  0.24864600  0.25043300  0.50000000  1
  Mg  Mg23  1  0.75135400  0.25043300  0.50000000  1
  Mg  Mg24  1  0.00000000  0.75145400  0.25079800  1
  Mg  Mg25  1  0.50000000  0.74642500  0.25349100  1
  Mg  Mg26  1  0.00000000  0.75145400  0.74920200  1
  Mg  Mg27  1  0.50000000  0.74642500  0.74650900  1
  Mg  Mg28  1  0.00000000  0.24804600  0.24835400  1
  Mg  Mg29  1  0.50000000  0.25317100  0.25346100  1
  Mg  Mg30  1  0.00000000  0.24804600  0.75164600  1
  Mg  Mg31  1  0.50000000  0.25317100  0.74653900  1
  O  O32  1  0.50000000  0.74526900  0.00000000  1
  O  O33  1  0.00000000  0.74889800  0.50000000  1
  O  O34  1  0.50000000  0.74935200  0.50000000  1
  O  O35  1  0.00000000  0.25594100  0.00000000  1
  O  O36  1  0.50000000  0.25425000  0.00000000  1
  O  O37  1  0.00000000  0.25052100  0.50000000  1
  O  O38  1  0.50000000  0.25040000  0.50000000  1
  O  O39  1  0.25122500  0.75058800  0.25008200  1
  O  O40  1  0.74877500  0.75058800  0.25008200  1
  O  O41  1  0.25122500  0.75058800  0.74991800  1
  O  O42  1  0.74877500  0.75058800  0.74991800  1
  O  O43  1  0.25057400  0.24899500  0.24919500  1
  O  O44  1  0.74942600  0.24899500  0.24919500  1
  O  O45  1  0.25057400  0.24899500  0.75080500  1
  O  O46  1  0.74942600  0.24899500  0.75080500  1
  O  O47  1  0.25707600  0.00038900  0.00000000  1
  O  O48  1  0.74292400  0.00038900  0.00000000  1
  O  O49  1  0.25116900  0.99982600  0.50000000  1
  O  O50  1  0.74883100  0.99982600  0.50000000  1
  O  O51  1  0.25204300  0.49900000  0.00000000  1
  O  O52  1  0.74795700  0.49900000  0.00000000  1
  O  O53  1  0.25052100  0.49985500  0.50000000  1
  O  O54  1  0.74947900  0.49985500  0.50000000  1
  O  O55  1  0.00000000  0.00015900  0.25647900  1
  O  O56  1  0.50000000  0.99983600  0.25443100  1
  O  O57  1  0.00000000  0.00015900  0.74352100  1
  O  O58  1  0.50000000  0.99983600  0.74556900  1
  O  O59  1  0.00000000  0.49888900  0.25196000  1
  O  O60  1  0.50000000  0.49984900  0.25060000  1
  O  O61  1  0.00000000  0.49888900  0.74804000  1
  O  O62  1  0.50000000  0.49984900  0.74940000  1
