# generated using pymatgen
data_MgTi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.10882975
_cell_length_b   8.10882975
_cell_length_c   4.87363500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   141.89760035
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgTi
_chemical_formula_sum   'Mg5 Ti5'
_cell_volume   197.74384607
_cell_formula_units_Z   5
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  0.00812300  0.39915300  0.00000000  1.0
  Mg  Mg1  1  0.06100400  0.66660000  0.50000000  1.0
  Mg  Mg2  1  0.88161800  0.88161800  0.50000000  1.0
  Mg  Mg3  1  0.39915300  0.00812300  0.00000000  1.0
  Mg  Mg4  1  0.66660000  0.06100400  0.50000000  1.0
  Ti  Ti5  1  0.28677700  0.46061400  0.50000000  1.0
  Ti  Ti6  1  0.77344200  0.59921200  0.00000000  1.0
  Ti  Ti7  1  0.59921200  0.77344200  0.00000000  1.0
  Ti  Ti8  1  0.19673500  0.19673500  0.00000000  1.0
  Ti  Ti9  1  0.46061400  0.28677700  0.50000000  1.0