data_Mn2Ag
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.39
_cell_length_b   5.39
_cell_length_c   6.66
_cell_angle_alpha   105.63
_cell_angle_beta   105.63
_cell_angle_gamma   31.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2Ag
_chemical_formula_sum   'Mn4 Ag2'
_cell_volume   95.97
_cell_formula_units_Z   2
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
  Mn  Mn2  1  0.53  0.0  0.78  1.0
  Mn  Mn3  1  0.42  0.0  0.89  1.0
  Mn  Mn4  1  0.24  0.0  0.3  1.0
  Mn  Mn5  1  0.71  0.0  0.96  1.0
  Ag  Ag0  1  0.49  0.0  0.39  1.0
  Ag  Ag1  1  0.36  0.0  0.2  1.0

data_Mn2Ag
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.89
_cell_length_b   5.39
_cell_length_c   6.66
_cell_angle_alpha   105.63
_cell_angle_beta   90.0
_cell_angle_gamma   105.56
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2Ag
_chemical_formula_sum   'Mn4 Ag2'
_cell_volume   95.97
_cell_formula_units_Z   2
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
  Mn  Mn0  1  0.0  0.29  0.04  1.0
  Mn  Mn1  1  0.0  0.47  0.22  1.0
  Mn  Mn2  1  0.0  0.58  0.11  1.0
  Mn  Mn3  1  0.0  0.76  0.7  1.0
  Ag  Ag4  1  0.0  0.51  0.61  1.0
  Ag  Ag5  1  0.0  0.64  0.8  1.0

Mn Mn Mn Mn Ag Ag
Mn Mn Mn Mn Ag Ag 0 1 o o o 0 3 o o o 1 3 o o o 2 5 o o o 2 4 o o o 4 5 o o o 