data_SrAgMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.51
_cell_length_b   7.51
_cell_length_c   7.51
_cell_angle_alpha   156.98
_cell_angle_beta   156.98
_cell_angle_gamma   32.78
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrAgMo
_chemical_formula_sum   'Sr1 Ag1 Mo1'
_cell_volume   64.76
_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  Sr2  1  0.0  0.0  0.64  1.0
  Ag  Ag0  1  0.0  0.0  0.18  1.0
  Mo  Mo1  1  0.0  0.0  0.01  1.0

data_SrAgMo
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.24
_cell_length_b   4.24
_cell_length_c   7.51
_cell_angle_alpha   90.0
_cell_angle_beta   106.39
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   SrAgMo
_chemical_formula_sum   'Sr2 Ag2 Mo2'
_cell_volume   129.53
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.36  1.0
  Ag  Ag1  2  0.0  0.0  0.82  1.0
  Mo  Mo2  2  0.0  0.0  0.99  1.0

Sr Ag Mo
Sr Ag Mo 0 0 + o + 0 0 o + + 0 1 o o o 0 2 o o + 1 2 o o o 