data_[Re1P2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Re  1.9000  1.3500  0.7125
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [3.0891]
_cell_length_b [4.2008]
_cell_length_c [4.3719]
_cell_angle_alpha [96.6738]
_cell_angle_beta [110.1165]
_cell_angle_gamma [99.5345]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [ReP2]
_chemical_formula_sum '[Re1 P2]'
_cell_volume [51.6095]
_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
[
  Re  Re0  1  0.2719  0.7853  0.1634  1
  P  P1  1  0.5883  0.8964  0.7518  1
  P  P2  1  0.6410  0.3478  0.1134  1
]