data_[Ta10Mo6]
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 [Cm]
_cell_length_a [10.7493]
_cell_length_b [9.1010]
_cell_length_c [2.8875]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.2085]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Ta5Mo3]
_chemical_formula_sum '[Ta10 Mo6]'
_cell_volume [277.0957]
_cell_formula_units_Z [2]
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  4  0.4992  0.2491  0.5057  1.0
  Ta  Ta1  2  0.1224  0.5000  0.2242  1.0
  Ta  Ta2  2  0.1309  0.0000  0.2495  1.0
  Ta  Ta3  2  0.3728  0.5000  0.7675  1.0
  Mo  Mo4  4  0.2503  0.2492  0.9967  1.0
  Mo  Mo5  2  0.3748  0.0000  0.7541  1.0
]