# generated using pymatgen
data_Lu4Ni5(Ge3Ru)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.98040335
_cell_length_b   6.98040348
_cell_length_c   6.98040410
_cell_angle_alpha   108.52930719
_cell_angle_beta   109.94421513
_cell_angle_gamma   109.94422265
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu4Ni5(Ge3Ru)2
_chemical_formula_sum   'Lu4 Ni5 Ge6 Ru2'
_cell_volume   261.77723286
_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
  Lu  Lu0  1  0.99825206  0.99912603  0.49912603  1.0
  Lu  Lu1  1  0.00174794  0.50087397  0.00087397  1.0
  Lu  Lu2  1  0.50000000  0.99912603  0.00087397  1.0
  Lu  Lu3  1  0.50000000  0.50087397  0.49912603  1.0
  Ni  Ni4  1  0.75244075  0.25426224  0.50182149  1.0
  Ni  Ni5  1  0.75244075  0.49817851  0.25061826  1.0
  Ni  Ni6  1  0.50000000  0.25000000  0.75000000  1.0
  Ni  Ni7  1  0.24755925  0.49817851  0.74573776  1.0
  Ni  Ni8  1  0.24755925  0.74938174  0.50182149  1.0
  Ge  Ge9  1  0.67771645  0.67499739  0.99728093  1.0
  Ge  Ge10  1  0.32228355  0.00271907  0.32500261  1.0
  Ge  Ge11  1  1.00000000  0.32526372  0.32526372  1.0
  Ge  Ge12  1  0.32228355  0.31956448  0.99728093  1.0
  Ge  Ge13  1  0.67771645  0.00271907  0.68043552  1.0
  Ge  Ge14  1  0.00000000  0.67473628  0.67473628  1.0
  Ru  Ru15  1  0.50000000  0.75000000  0.25000000  1.0
  Ru  Ru16  1  0.00000000  0.00000000  0.00000000  1.0