# generated using pymatgen
data_LiMg6Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.08867801
_cell_length_b   6.08867801
_cell_length_c   4.34089102
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.17879993
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMg6Mo
_chemical_formula_sum   'Li1 Mg6 Mo1'
_cell_volume   160.92472804
_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  0.62502012  0.37497988  0.00000000  1
  Mg  Mg1  1  0.62498304  0.87498502  0.00000000  1
  Mg  Mg2  1  0.12501498  0.37501696  0.00000000  1
  Mg  Mg3  1  0.88657990  0.63659567  0.50000000  1
  Mg  Mg4  1  0.36340433  0.11342010  0.50000000  1
  Mg  Mg5  1  0.88800923  0.11199077  0.50000000  1
  Mg  Mg6  1  0.36199838  0.63800162  0.50000000  1
  Mo  Mo7  1  0.12499402  0.87500598  0.00000000  1
