# generated using pymatgen
data_ErScP7Ru12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.31431858
_cell_length_b   9.31431774
_cell_length_c   3.90930443
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999253
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErScP7Ru12
_chemical_formula_sum   'Er1 Sc1 P7 Ru12'
_cell_volume   293.71917072
_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
  Er  Er0  1  0.33333300  0.66666700  0.00000000  1.0
  Sc  Sc1  1  0.66666700  0.33333300  0.50000000  1.0
  P  P2  1  0.59999528  0.71821702  0.50000000  1.0
  P  P3  1  0.00000000  0.00000000  0.00000000  1.0
  P  P4  1  0.28178298  0.88177826  0.50000000  1.0
  P  P5  1  0.11822174  0.40000472  0.50000000  1.0
  P  P6  1  0.88305185  0.57209330  0.00000000  1.0
  P  P7  1  0.42790670  0.31095755  0.00000000  1.0
  P  P8  1  0.68904245  0.11694815  0.00000000  1.0
  Ru  Ru9  1  0.55644973  0.95090882  0.50000000  1.0
  Ru  Ru10  1  0.39446109  0.44355027  0.50000000  1.0
  Ru  Ru11  1  0.91475507  0.12154525  0.50000000  1.0
  Ru  Ru12  1  0.20679017  0.08524493  0.50000000  1.0
  Ru  Ru13  1  0.87845475  0.79320983  0.50000000  1.0
  Ru  Ru14  1  0.72691548  0.89109735  0.00000000  1.0
  Ru  Ru15  1  0.10890265  0.83581713  0.00000000  1.0
  Ru  Ru16  1  0.16418287  0.27308452  0.00000000  1.0
  Ru  Ru17  1  0.42620728  0.06950747  0.00000000  1.0
  Ru  Ru18  1  0.93049253  0.35669982  0.00000000  1.0
  Ru  Ru19  1  0.64330018  0.57379272  0.00000000  1.0
  Ru  Ru20  1  0.04909118  0.60553891  0.50000000  1.0