# generated using pymatgen
data_MgTi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85273500
_cell_length_b   5.99109800
_cell_length_c   15.98246400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgTi
_chemical_formula_sum   'Mg12 Ti12'
_cell_volume   464.66154742
_cell_formula_units_Z   12
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
  Mg  Mg0  1  0.25000000  0.88253800  0.86419400  1.0
  Mg  Mg1  1  0.25000000  0.36807200  0.86399700  1.0
  Mg  Mg2  1  0.75000000  0.62585700  0.80889100  1.0
  Mg  Mg3  1  0.25000000  0.62585700  0.69110900  1.0
  Mg  Mg4  1  0.75000000  0.88253800  0.63580600  1.0
  Mg  Mg5  1  0.75000000  0.36807200  0.63600300  1.0
  Mg  Mg6  1  0.25000000  0.63192800  0.36399700  1.0
  Mg  Mg7  1  0.25000000  0.11746200  0.36419400  1.0
  Mg  Mg8  1  0.75000000  0.37414300  0.30889100  1.0
  Mg  Mg9  1  0.25000000  0.37414300  0.19110900  1.0
  Mg  Mg10  1  0.75000000  0.63192800  0.13600300  1.0
  Mg  Mg11  1  0.75000000  0.11746200  0.13580600  1.0
  Ti  Ti12  1  0.75000000  0.87909800  0.97561000  1.0
  Ti  Ti13  1  0.75000000  0.36983300  0.97250200  1.0
  Ti  Ti14  1  0.75000000  0.12621900  0.80619300  1.0
  Ti  Ti15  1  0.25000000  0.12621900  0.69380700  1.0
  Ti  Ti16  1  0.25000000  0.87909800  0.52439000  1.0
  Ti  Ti17  1  0.25000000  0.36983300  0.52749800  1.0
  Ti  Ti18  1  0.75000000  0.63016700  0.47250200  1.0
  Ti  Ti19  1  0.75000000  0.12090200  0.47561000  1.0
  Ti  Ti20  1  0.75000000  0.87378100  0.30619300  1.0
  Ti  Ti21  1  0.25000000  0.87378100  0.19380700  1.0
  Ti  Ti22  1  0.25000000  0.63016700  0.02749800  1.0
  Ti  Ti23  1  0.25000000  0.12090200  0.02439000  1.0