data_CuGeMo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.74
_cell_length_b   2.74
_cell_length_c   8.3
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   105.35
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuGeMo2
_chemical_formula_sum   'Cu1 Ge1 Mo2'
_cell_volume   59.88
_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
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  Ge  Ge1  1  0.0  0.0  0.15  1.0
  Mo  Mo2  1  0.66  0.0  0.22  1.0
  Mo  Mo3  1  0.66  0.0  0.08  1.0

data_CuGeMo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.74
_cell_length_b   2.74
_cell_length_c   8.3
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   105.35
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuGeMo2
_chemical_formula_sum   'Cu1 Ge1 Mo2'
_cell_volume   59.88
_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
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  Ge  Ge1  1  0.0  0.0  0.15  1.0
  Mo  Mo2  1  0.66  0.0  0.08  1.0
  Mo  Mo3  1  0.66  0.0  0.22  1.0

Cu Ge Mo Mo