data_[Ni10P7]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P6mm]
_cell_length_a [6.9974]
_cell_length_b [6.9974]
_cell_length_c [18.6697]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [183]
_chemical_formula_structural [Ni10P7]
_chemical_formula_sum '[Ni10 P7]'
_cell_volume [791.6593]
_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
[
  Ni  Ni0  6  0.2148  0.4295  0.4145  1
  Ni  Ni1  3  0.0000  0.5000  0.5853  1
  Ni  Ni2  1  0.0000  0.0000  0.4903  1
  P  P3  6  0.1938  0.3877  0.5260  1
  P  P4  1  0.0000  0.0000  0.6110  1
]