# generated using pymatgen
data_NdMgP7Ru12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.36906612
_cell_length_b   9.36906470
_cell_length_c   3.91334846
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999972
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdMgP7Ru12
_chemical_formula_sum   'Nd1 Mg1 P7 Ru12'
_cell_volume   297.48953688
_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
  Nd  Nd0  1  0.33333300  0.66666700  0.00000000  1.0
  Mg  Mg1  1  0.66666700  0.33333300  0.50000000  1.0
  P  P2  1  0.60483013  0.71638500  0.50000000  1.0
  P  P3  1  0.00000000  0.00000000  0.00000000  1.0
  P  P4  1  0.28361500  0.88844513  0.50000000  1.0
  P  P5  1  0.11155487  0.39516987  0.50000000  1.0
  P  P6  1  0.88877747  0.57787183  0.00000000  1.0
  P  P7  1  0.42212817  0.31090564  0.00000000  1.0
  P  P8  1  0.68909436  0.11122253  0.00000000  1.0
  Ru  Ru9  1  0.56001637  0.95573446  0.50000000  1.0
  Ru  Ru10  1  0.39571909  0.43998363  0.50000000  1.0
  Ru  Ru11  1  0.91417472  0.11842567  0.50000000  1.0
  Ru  Ru12  1  0.20425195  0.08582528  0.50000000  1.0
  Ru  Ru13  1  0.88157433  0.79574805  0.50000000  1.0
  Ru  Ru14  1  0.72698829  0.88700307  0.00000000  1.0
  Ru  Ru15  1  0.11299693  0.83998422  0.00000000  1.0
  Ru  Ru16  1  0.16001578  0.27301171  0.00000000  1.0
  Ru  Ru17  1  0.42892039  0.07440521  0.00000000  1.0
  Ru  Ru18  1  0.92559479  0.35451719  0.00000000  1.0
  Ru  Ru19  1  0.64548281  0.57107961  0.00000000  1.0
  Ru  Ru20  1  0.04426554  0.60428091  0.50000000  1.0