# generated using pymatgen
data_LiMg6Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.86804800
_cell_length_b   6.24985100
_cell_length_c   10.48937000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMg6Ni
_chemical_formula_sum   'Li2 Mg12 Ni2'
_cell_volume   319.13462071
_cell_formula_units_Z   2
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  0.50000000  0.50000000  0.83389600  1
  Li  Li1  1  0.50000000  0.00000000  0.33389600  1
  Mg  Mg2  1  0.50000000  0.24985800  0.08428200  1
  Mg  Mg3  1  0.50000000  0.75014200  0.08428200  1
  Mg  Mg4  1  0.00000000  0.23939400  0.91041000  1
  Mg  Mg5  1  0.00000000  0.76060600  0.91041000  1
  Mg  Mg6  1  0.00000000  0.50000000  0.17455300  1
  Mg  Mg7  1  0.00000000  0.50000000  0.66854300  1
  Mg  Mg8  1  0.50000000  0.74985800  0.58428200  1
  Mg  Mg9  1  0.50000000  0.25014200  0.58428200  1
  Mg  Mg10  1  0.00000000  0.73939400  0.41041000  1
  Mg  Mg11  1  0.00000000  0.26060600  0.41041000  1
  Mg  Mg12  1  0.00000000  0.00000000  0.67455300  1
  Mg  Mg13  1  0.00000000  0.00000000  0.16854300  1
  Ni  Ni14  1  0.50000000  0.50000000  0.33362700  1
  Ni  Ni15  1  0.50000000  0.00000000  0.83362700  1
