data_SrTa2Co
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.99
_cell_length_b   5.99
_cell_length_c   5.12
_cell_angle_alpha   110.79
_cell_angle_beta   110.79
_cell_angle_gamma   28.45
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrTa2Co
_chemical_formula_sum   'Sr1 Ta2 Co1'
_cell_volume   81.31
_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  Sr1  1  0.87  0.0  0.38  1.0
  Ta  Ta2  1  0.77  0.0  0.86  1.0
  Ta  Ta3  1  0.96  0.0  0.9  1.0
  Co  Co0  1  0.0  0.0  0.0  1.0

data_SrTa2Co
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.94
_cell_length_b   5.12
_cell_length_c   5.99
_cell_angle_alpha   110.79
_cell_angle_beta   104.22
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrTa2Co
_chemical_formula_sum   'Sr1 Ta2 Co1'
_cell_volume   81.31
_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  0.87  1.0
  Ta  Ta1  1  0.0  0.86  0.77  1.0
  Ta  Ta2  1  0.0  0.9  0.96  1.0
  Co  Co3  1  0.0  0.0  0.0  1.0

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