data_[Ta4Mo4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Mo  2.1600  1.4500  0.7750
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.2367]
_cell_length_b [4.5989]
_cell_length_c [9.1237]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [TaMo]
_chemical_formula_sum '[Ta4 Mo4]'
_cell_volume [135.8095]
_cell_formula_units_Z [4]
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
[
  Ta  Ta0  1  0.0000  0.5000  0.2425  1.0
  Ta  Ta1  1  0.0000  0.5000  0.7589  1.0
  Ta  Ta2  1  0.5000  0.0000  0.7499  1.0
  Ta  Ta3  1  0.5000  0.5000  0.5002  1.0
  Mo  Mo4  1  0.0000  0.0000  0.0040  1.0
  Mo  Mo5  1  0.0000  0.0000  0.4942  1.0
  Mo  Mo6  1  0.5000  0.0000  0.2494  1.0
  Mo  Mo7  1  0.5000  0.5000  0.0008  1.0
]