data_K2MgTi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.36
_cell_length_b   6.46
_cell_length_c   6.3
_cell_angle_alpha   90.0
_cell_angle_beta   95.37
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2MgTi
_chemical_formula_sum   'K2 Mg1 Ti1'
_cell_volume   135.95
_cell_formula_units_Z   1
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
  K  K0  1  0.36  0.23  0.59  1.0
  K  K1  1  0.41  0.23  0.68  1.0
  Mg  Mg2  1  0.0  0.0  0.0  1.0
  Ti  Ti3  1  0.38  0.0  0.13  1.0

data_K2MgTi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.36
_cell_length_b   6.3
_cell_length_c   6.46
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   95.37
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2MgTi
_chemical_formula_sum   'K2 Mg1 Ti1'
_cell_volume   135.95
_cell_formula_units_Z   1
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
  K  K0  1  0.59  0.32  0.77  1.0
  K  K1  1  0.64  0.41  0.77  1.0
  Mg  Mg2  1  0.0  0.0  0.0  1.0
  Ti  Ti3  1  0.62  0.87  0.0  1.0

K K Mg Ti