data_CaMn2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.29
_cell_length_b   4.35
_cell_length_c   6.27
_cell_angle_alpha   90.0
_cell_angle_beta   104.53
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaMn2Sb
_chemical_formula_sum   'Ca1 Mn2 Sb1'
_cell_volume   86.85
_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  0.85  0.0  0.47  1.0
  Mn  Mn1  1  0.1  0.18  0.47  1.0
  Mn  Mn2  1  0.47  0.0  0.31  1.0
  Sb  Sb3  1  0.46  0.18  0.84  1.0

data_CaMn2Sb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.29
_cell_length_b   4.35
_cell_length_c   6.27
_cell_angle_alpha   90.0
_cell_angle_beta   104.53
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaMn2Sb
_chemical_formula_sum   'Ca1 Mn2 Sb1'
_cell_volume   86.85
_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  0.85  0.0  0.47  1.0
  Mn  Mn1  1  0.1  0.18  0.47  1.0
  Mn  Mn2  1  0.47  0.0  0.31  1.0
  Sb  Sb3  1  0.46  0.18  0.84  1.0

Ca Mn Mn Sb