data_VBMo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.72
_cell_length_b   3.98
_cell_length_c   5.02
_cell_angle_alpha   90.0
_cell_angle_beta   100.72
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VBMo2
_chemical_formula_sum   'V1 B1 Mo2'
_cell_volume   53.33
_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  0.89  0.0  0.46  1.0
  B  B0  1  0.0  0.0  0.0  1.0
  Mo  Mo1  1  0.84  0.99  0.2  1.0
  Mo  Mo2  1  0.94  0.99  0.73  1.0

data_VBMo2
_symmetry_space_group_name_H-M   Pm
_cell_length_a   2.72
_cell_length_b   3.98
_cell_length_c   5.02
_cell_angle_alpha   90.0
_cell_angle_beta   100.72
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   VBMo2
_chemical_formula_sum   'V1 B1 Mo2'
_cell_volume   53.33
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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  0.89  0.0  0.46  1.0
  B  B1  1  0.0  0.0  0.0  1.0
  Mo  Mo2  1  0.84  0.0  0.2  1.0
  Mo  Mo3  1  0.94  0.0  0.73  1.0

V B Mo Mo