data_CoAg2Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.11
_cell_length_b   5.11
_cell_length_c   5.11
_cell_angle_alpha   137.15
_cell_angle_beta   137.15
_cell_angle_gamma   62.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoAg2Mo
_chemical_formula_sum   'Co1 Ag2 Mo1'
_cell_volume   61.12
_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
  Co  Co2  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.0  0.87  0.19  1.0
  Ag  Ag1  1  0.87  0.0  0.19  1.0
  Mo  Mo3  1  0.0  0.0  0.38  1.0

data_CoAg2Mo
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.28
_cell_length_b   5.28
_cell_length_c   5.11
_cell_angle_alpha   90.0
_cell_angle_beta   121.1
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   CoAg2Mo
_chemical_formula_sum   'Co2 Ag4 Mo2'
_cell_volume   122.23
_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
  Co  Co0  2  0.0  0.0  0.0  1.0
  Ag  Ag1  4  0.24  0.43  0.68  1.0
  Mo  Mo2  2  0.12  0.5  0.62  1.0

Co Ag Ag Mo
Co Ag Ag Mo 0 2 - o o 0 1 o - o 1 2 - + o 1 3 o + o 2 3 + o o 