# generated using pymatgen
data_Nd3RuO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.60662235
_cell_length_b   6.60662235
_cell_length_c   7.52891995
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   112.20727569
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd3RuO7
_chemical_formula_sum   'Nd6 Ru2 O14'
_cell_volume   304.24217760
_cell_formula_units_Z   2
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  0.46731988  0.90804479  0.75000000  1.0
  Nd  Nd1  1  0.53268012  0.09195521  0.25000000  1.0
  Nd  Nd2  1  0.90804479  0.46731988  0.75000000  1.0
  Nd  Nd3  1  0.09195521  0.53268012  0.25000000  1.0
  Nd  Nd4  1  -0.00000000  0.00000000  0.50000000  1.0
  Nd  Nd5  1  -0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru6  1  0.50000000  0.50000000  0.50000000  1.0
  Ru  Ru7  1  0.50000000  0.50000000  0.00000000  1.0
  O  O8  1  0.58297351  0.58297351  0.75000000  1.0
  O  O9  1  0.41702649  0.41702649  0.25000000  1.0
  O  O10  1  0.83897979  0.10122959  0.75000000  1.0
  O  O11  1  0.16102021  0.89877041  0.25000000  1.0
  O  O12  1  0.10122959  0.83897979  0.75000000  1.0
  O  O13  1  0.89877041  0.16102021  0.25000000  1.0
  O  O14  1  0.44099766  0.19072045  0.95844714  1.0
  O  O15  1  0.55900234  0.80927955  0.45844714  1.0
  O  O16  1  0.19072045  0.44099766  0.95844714  1.0
  O  O17  1  0.80927955  0.55900234  0.45844714  1.0
  O  O18  1  0.44099766  0.19072045  0.54155286  1.0
  O  O19  1  0.55900234  0.80927955  0.04155286  1.0
  O  O20  1  0.80927955  0.55900234  0.04155286  1.0
  O  O21  1  0.19072045  0.44099766  0.54155286  1.0