data_VTcRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.69
_cell_length_b   4.69
_cell_length_c   4.69
_cell_angle_alpha   131.72
_cell_angle_beta   131.72
_cell_angle_gamma   70.67
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VTcRh2
_chemical_formula_sum   'V1 Tc1 Rh2'
_cell_volume   56.24
_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  0.0  1.0
  Tc  Tc2  1  0.0  0.92  0.91  1.0
  Rh  Rh0  1  0.92  0.0  0.91  1.0
  Rh  Rh1  1  0.0  0.0  0.82  1.0

data_VTcRh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.83
_cell_length_b   3.83
_cell_length_c   4.69
_cell_angle_alpha   114.14
_cell_angle_beta   114.14
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VTcRh2
_chemical_formula_sum   'V1 Tc1 Rh2'
_cell_volume   56.24
_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
  Tc  Tc1  1  0.01  0.92  0.01  1.0
  Rh  Rh2  1  0.09  0.0  0.01  1.0
  Rh  Rh3  1  0.18  0.0  0.18  1.0

V Tc Rh Rh
V Tc Rh Rh 0 2 - o - 0 1 o - - 0 3 o o - 1 3 o + o 2 3 + o o 