# generated using pymatgen
data_MgTi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.66153011
_cell_length_b   5.66153011
_cell_length_c   7.44959506
_cell_angle_alpha   76.10091227
_cell_angle_beta   76.10091227
_cell_angle_gamma   30.41558554
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgTi
_chemical_formula_sum   'Mg3 Ti3'
_cell_volume   117.08206337
_cell_formula_units_Z   3
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  0.61181500  0.61181500  0.27535300  1.0
  Mg  Mg1  1  0.33390400  0.33390400  0.32759800  1.0
  Mg  Mg2  1  0.94195300  0.94195300  0.61908900  1.0
  Ti  Ti3  1  0.00447000  0.00447000  0.98197700  1.0
  Ti  Ti4  1  0.66320600  0.66320600  0.69575500  1.0
  Ti  Ti5  1  0.27798500  0.27798500  0.93356100  1.0