# generated using pymatgen
data_MoPRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.85743999
_cell_length_b   6.01326427
_cell_length_c   6.01315085
_cell_angle_alpha   120.00048896
_cell_angle_beta   89.99999994
_cell_angle_gamma   89.99999831
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MoPRu
_chemical_formula_sum   'Mo3 P3 Ru3'
_cell_volume   120.79252511
_cell_formula_units_Z   3
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
  Mo  Mo0  1  0.49999998  0.59405493  0.99999907  1.0
  Mo  Mo1  1  0.50000000  0.40592649  0.40593097  1.0
  Mo  Mo2  1  0.50000001  0.99999461  0.59406789  1.0
  P  P3  1  -0.00000002  0.33332591  0.66666900  1.0
  P  P4  1  -0.00000000  0.66665320  0.33332997  1.0
  P  P5  1  0.50000000  0.99999405  0.00000220  1.0
  Ru  Ru6  1  0.00000002  0.26156084  0.00000390  1.0
  Ru  Ru7  1  0.00000000  0.73840691  0.73842575  1.0
  Ru  Ru8  1  -0.00000000  0.99998506  0.26157126  1.0