# generated using pymatgen
data_NdErP7Ru12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.37523670
_cell_length_b   9.37523619
_cell_length_c   3.93822504
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999488
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdErP7Ru12
_chemical_formula_sum   'Nd1 Er1 P7 Ru12'
_cell_volume   299.77515900
_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
  Er  Er1  1  0.66666700  0.33333300  0.50000000  1.0
  P  P2  1  0.60477165  0.71771654  0.50000000  1.0
  P  P3  1  0.00000000  0.00000000  0.00000000  1.0
  P  P4  1  0.28228346  0.88705511  0.50000000  1.0
  P  P5  1  0.11294489  0.39522835  0.50000000  1.0
  P  P6  1  0.88659657  0.57342178  0.00000000  1.0
  P  P7  1  0.42657822  0.31317479  0.00000000  1.0
  P  P8  1  0.68682521  0.11340343  0.00000000  1.0
  Ru  Ru9  1  0.55980896  0.95428325  0.50000000  1.0
  Ru  Ru10  1  0.39447629  0.44019104  0.50000000  1.0
  Ru  Ru11  1  0.91420322  0.11988600  0.50000000  1.0
  Ru  Ru12  1  0.20568278  0.08579678  0.50000000  1.0
  Ru  Ru13  1  0.88011400  0.79431722  0.50000000  1.0
  Ru  Ru14  1  0.72887138  0.89156986  0.00000000  1.0
  Ru  Ru15  1  0.10843014  0.83730052  0.00000000  1.0
  Ru  Ru16  1  0.16269948  0.27112862  0.00000000  1.0
  Ru  Ru17  1  0.42372506  0.06912111  0.00000000  1.0
  Ru  Ru18  1  0.93087889  0.35460595  0.00000000  1.0
  Ru  Ru19  1  0.64539405  0.57627494  0.00000000  1.0
  Ru  Ru20  1  0.04571675  0.60552371  0.50000000  1.0