# generated using pymatgen
data_LiCaMg6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.27969400
_cell_length_b   6.51239600
_cell_length_c   11.54481000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCaMg6
_chemical_formula_sum   'Li2 Ca2 Mg12'
_cell_volume   396.95049076
_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  0.16538800  1
  Li  Li1  1  0.50000000  0.00000000  0.66538800  1
  Ca  Ca2  1  0.50000000  0.00000000  0.16717700  1
  Ca  Ca3  1  0.50000000  0.50000000  0.66717700  1
  Mg  Mg4  1  0.50000000  0.24660900  0.41818800  1
  Mg  Mg5  1  0.50000000  0.75339100  0.41818800  1
  Mg  Mg6  1  0.00000000  0.74293800  0.08152700  1
  Mg  Mg7  1  0.00000000  0.25706200  0.08152700  1
  Mg  Mg8  1  0.00000000  0.00000000  0.33629800  1
  Mg  Mg9  1  0.00000000  0.50000000  0.33170300  1
  Mg  Mg10  1  0.50000000  0.74660900  0.91818800  1
  Mg  Mg11  1  0.50000000  0.25339100  0.91818800  1
  Mg  Mg12  1  0.00000000  0.24293800  0.58152700  1
  Mg  Mg13  1  0.00000000  0.75706200  0.58152700  1
  Mg  Mg14  1  0.00000000  0.50000000  0.83629800  1
  Mg  Mg15  1  0.00000000  0.00000000  0.83170300  1
