data_SrMg2Co
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.22
_cell_length_b   6.22
_cell_length_c   5.25
_cell_angle_alpha   114.16
_cell_angle_beta   114.16
_cell_angle_gamma   30.75
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrMg2Co
_chemical_formula_sum   'Sr1 Mg2 Co1'
_cell_volume   93.83
_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
  Sr  Sr3  1  0.88  0.0  0.38  1.0
  Mg  Mg1  1  0.88  0.0  0.85  1.0
  Mg  Mg2  1  0.88  0.0  0.9  1.0
  Co  Co0  1  0.0  0.0  0.0  1.0

data_SrMg2Co
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.3
_cell_length_b   5.25
_cell_length_c   6.22
_cell_angle_alpha   114.16
_cell_angle_beta   105.37
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrMg2Co
_chemical_formula_sum   'Sr1 Mg2 Co1'
_cell_volume   93.83
_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
  Sr  Sr0  1  0.0  0.38  0.88  1.0
  Mg  Mg1  1  0.0  0.85  0.88  1.0
  Mg  Mg2  1  0.0  0.9  0.88  1.0
  Co  Co3  1  0.0  0.0  0.0  1.0

Sr Mg Mg Co
Sr Mg Mg Co 0 1 o o - 0 1 o o o 0 3 + o o 0 2 o o - 0 2 o o o 1 2 o o o 1 3 + o + 2 3 + o + 