data_NaMn2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.45
_cell_length_b   6.45
_cell_length_c   6.45
_cell_angle_alpha   152.16
_cell_angle_beta   139.74
_cell_angle_gamma   49.65
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaMn2Cl
_chemical_formula_sum   'Na1 Mn2 Cl1'
_cell_volume   80.48
_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
  Na  Na3  1  0.0  0.0  0.0  1.0
  Mn  Mn1  1  0.0  0.22  0.53  1.0
  Mn  Mn2  1  0.55  0.0  0.32  1.0
  Cl  Cl0  1  0.0  0.0  0.85  1.0

data_NaMn2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.1
_cell_length_b   4.44
_cell_length_c   6.45
_cell_angle_alpha   110.13
_cell_angle_beta   103.92
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaMn2Cl
_chemical_formula_sum   'Na1 Mn2 Cl1'
_cell_volume   80.48
_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
  Na  Na0  1  0.0  0.0  0.0  1.0
  Mn  Mn1  1  0.23  0.68  0.23  1.0
  Mn  Mn2  1  0.47  0.69  0.69  1.0
  Cl  Cl3  1  0.15  0.15  0.15  1.0

Na Mn Mn Cl