# generated using pymatgen
data_Mg2Ti
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.21582963
_cell_length_b   8.21582963
_cell_length_c   5.08384700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   158.95765619
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2Ti
_chemical_formula_sum   'Mg4 Ti2'
_cell_volume   123.21389644
_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
  Mg  Mg0  1  0.55520600  0.44479400  0.25000000  1.0
  Mg  Mg1  1  0.22234900  0.77765100  0.25000000  1.0
  Mg  Mg2  1  0.77765100  0.22234900  0.75000000  1.0
  Mg  Mg3  1  0.44479400  0.55520600  0.75000000  1.0
  Ti  Ti4  1  0.89193600  0.10806400  0.25000000  1.0
  Ti  Ti5  1  0.10806400  0.89193600  0.75000000  1.0