# generated using pymatgen
data_Mg7Nb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.31014263
_cell_length_b   6.31014263
_cell_length_c   5.00494100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000660
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg7Nb
_chemical_formula_sum   'Mg7 Nb1'
_cell_volume   172.58693521
_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
  Mg  Mg0  1  0.83192600  0.66385200  0.50000000  1.0
  Mg  Mg1  1  0.33614800  0.16807400  0.50000000  1.0
  Mg  Mg2  1  0.83192600  0.16807400  0.50000000  1.0
  Mg  Mg3  1  0.49245700  0.50754300  0.00000000  1.0
  Mg  Mg4  1  0.01508600  0.50754300  0.00000000  1.0
  Mg  Mg5  1  0.49245700  0.98491400  0.00000000  1.0
  Mg  Mg6  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb7  1  0.33333300  0.66666700  0.50000000  1.0