# generated using pymatgen
data_Mg6TiNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.76109500
_cell_length_b   6.02523800
_cell_length_c   10.89647500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg6TiNi
_chemical_formula_sum   'Mg12 Ti2 Ni2'
_cell_volume   312.58424190
_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  0.00000000  0.74105300  0.08406600  1.0
  Mg  Mg1  1  0.00000000  0.25894700  0.08406600  1.0
  Mg  Mg2  1  0.00000000  0.00000000  0.32786600  1.0
  Mg  Mg3  1  0.50000000  0.25768500  0.42210700  1.0
  Mg  Mg4  1  0.50000000  0.74231500  0.42210700  1.0
  Mg  Mg5  1  0.50000000  0.00000000  0.16753000  1.0
  Mg  Mg6  1  0.00000000  0.24105300  0.58406600  1.0
  Mg  Mg7  1  0.00000000  0.75894700  0.58406600  1.0
  Mg  Mg8  1  0.00000000  0.50000000  0.82786600  1.0
  Mg  Mg9  1  0.50000000  0.75768500  0.92210700  1.0
  Mg  Mg10  1  0.50000000  0.24231500  0.92210700  1.0
  Mg  Mg11  1  0.50000000  0.50000000  0.66753000  1.0
  Ti  Ti12  1  0.50000000  0.50000000  0.18978000  1.0
  Ti  Ti13  1  0.50000000  0.00000000  0.68978000  1.0
  Ni  Ni14  1  0.00000000  0.50000000  0.30247700  1.0
  Ni  Ni15  1  0.00000000  0.00000000  0.80247700  1.0