data_VCu2Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.89
_cell_length_b   4.89
_cell_length_c   4.89
_cell_angle_alpha   143.97
_cell_angle_beta   126.37
_cell_angle_gamma   66.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCu2Mo
_chemical_formula_sum   'V1 Cu2 Mo1'
_cell_volume   54.52
_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
  V  V3  1  0.0  0.0  0.08  1.0
  Cu  Cu0  1  0.51  0.0  0.01  1.0
  Cu  Cu1  1  0.0  0.0  0.99  1.0
  Mo  Mo2  1  0.0  0.2  0.09  1.0

data_VCu2Mo
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.02
_cell_length_b   4.41
_cell_length_c   4.89
_cell_angle_alpha   116.82
_cell_angle_beta   108.02
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCu2Mo
_chemical_formula_sum   'V1 Cu2 Mo1'
_cell_volume   54.52
_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
  V  V0  1  0.92  0.92  0.92  1.0
  Cu  Cu1  1  0.01  0.01  0.01  1.0
  Cu  Cu2  1  0.5  0.99  0.5  1.0
  Mo  Mo3  1  0.91  0.11  0.11  1.0

V Cu Cu Mo