data_[V16Ga4Re4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Ga  1.8100  1.3000  0.7600
  Re  1.9000  1.3500  0.7125
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.1603]
_cell_length_b [17.5437]
_cell_length_c [5.0992]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [V4GaRe]
_chemical_formula_sum '[V16 Ga4 Re4]'
_cell_volume [372.1811]
_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
[
  V  V0  4  0.0000  0.1367  0.2569  1
  V  V1  4  0.0000  0.2814  0.4834  1
  V  V2  4  0.0000  0.2940  0.9671  1
  V  V3  4  0.0000  0.4361  0.0408  1
  Ga  Ga4  4  0.0000  0.1401  0.7538  1
  Re  Re5  4  0.0000  0.4228  0.5645  1
]