# generated using pymatgen
data_Nd3ThMgRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.97993378
_cell_length_b   9.97993376
_cell_length_c   9.97993424
_cell_angle_alpha   59.99999840
_cell_angle_beta   59.99999848
_cell_angle_gamma   60.00000270
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd3ThMgRu
_chemical_formula_sum   'Nd12 Th4 Mg4 Ru4'
_cell_volume   702.85865826
_cell_formula_units_Z   4
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  0.81095632  0.18904368  0.18904368  1.0
  Nd  Nd1  1  0.18904368  0.81095632  0.81095632  1.0
  Nd  Nd2  1  0.18904368  0.81095632  0.18904368  1.0
  Nd  Nd3  1  0.81095632  0.18904368  0.81095632  1.0
  Nd  Nd4  1  0.18904368  0.18904368  0.81095632  1.0
  Nd  Nd5  1  0.81095632  0.81095632  0.18904368  1.0
  Nd  Nd6  1  0.93900978  0.56099022  0.56099022  1.0
  Nd  Nd7  1  0.56099022  0.93900978  0.93900978  1.0
  Nd  Nd8  1  0.56099022  0.93900978  0.56099022  1.0
  Nd  Nd9  1  0.93900978  0.56099022  0.93900978  1.0
  Nd  Nd10  1  0.56099022  0.56099022  0.93900978  1.0
  Nd  Nd11  1  0.93900978  0.93900978  0.56099022  1.0
  Th  Th12  1  0.34361606  0.34361606  0.34361606  1.0
  Th  Th13  1  0.34361606  0.34361606  0.96915382  1.0
  Th  Th14  1  0.34361606  0.96915382  0.34361606  1.0
  Th  Th15  1  0.96915382  0.34361606  0.34361606  1.0
  Mg  Mg16  1  0.57876653  0.57876653  0.57876653  1.0
  Mg  Mg17  1  0.57876653  0.57876653  0.26369741  1.0
  Mg  Mg18  1  0.57876653  0.26369741  0.57876653  1.0
  Mg  Mg19  1  0.26369741  0.57876653  0.57876653  1.0
  Ru  Ru20  1  0.14566446  0.14566446  0.14566446  1.0
  Ru  Ru21  1  0.14566446  0.14566446  0.56300563  1.0
  Ru  Ru22  1  0.14566446  0.56300563  0.14566446  1.0
  Ru  Ru23  1  0.56300563  0.14566446  0.14566446  1.0