data_V2HgMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.95
_cell_length_b   4.95
_cell_length_c   4.95
_cell_angle_alpha   133.28
_cell_angle_beta   133.28
_cell_angle_gamma   68.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2HgMo
_chemical_formula_sum   'V2 Hg1 Mo1'
_cell_volume   63.04
_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  V2  1  0.0  0.96  0.05  1.0
  V  V3  1  0.0  0.0  0.0  1.0
  Hg  Hg0  1  0.96  0.0  0.05  1.0
  Mo  Mo1  1  0.0  0.0  0.1  1.0

data_V2HgMo
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.92
_cell_length_b   3.92
_cell_length_c   4.95
_cell_angle_alpha   113.36
_cell_angle_beta   113.36
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2HgMo
_chemical_formula_sum   'V2 Hg1 Mo1'
_cell_volume   63.04
_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  0.0  0.0  0.0  1.0
  V  V1  1  0.91  0.96  0.91  1.0
  Hg  Hg2  1  0.95  0.0  0.91  1.0
  Mo  Mo3  1  0.9  0.0  0.9  1.0

V V Hg Mo