data_CaTaMn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.29
_cell_length_b   5.29
_cell_length_c   5.14
_cell_angle_alpha   102.23
_cell_angle_beta   102.23
_cell_angle_gamma   30.78
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaTaMn2
_chemical_formula_sum   'Ca1 Ta1 Mn2'
_cell_volume   71.96
_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
  Ca  Ca0  1  0.23  0.0  0.97  1.0
  Ta  Ta3  1  0.69  0.0  0.9  1.0
  Mn  Mn1  1  0.85  0.0  0.1  1.0
  Mn  Mn2  1  0.05  0.0  0.55  1.0

data_CaTaMn2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.81
_cell_length_b   5.14
_cell_length_c   5.29
_cell_angle_alpha   102.23
_cell_angle_beta   105.39
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaTaMn2
_chemical_formula_sum   'Ca1 Ta1 Mn2'
_cell_volume   71.96
_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
  Ca  Ca0  1  0.0  0.97  0.23  1.0
  Ta  Ta1  1  0.0  0.9  0.69  1.0
  Mn  Mn2  1  0.0  0.1  0.85  1.0
  Mn  Mn3  1  0.0  0.55  0.05  1.0

Ca Ta Mn Mn