# generated using pymatgen
data_LiNbP7Ru12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.28832547
_cell_length_b   9.28832566
_cell_length_c   3.87739962
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000093
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNbP7Ru12
_chemical_formula_sum   'Li1 Nb1 P7 Ru12'
_cell_volume   289.69836878
_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
  Li  Li0  1  0.33333300  0.66666700  0.00000000  1.0
  Nb  Nb1  1  0.66666700  0.33333300  0.50000000  1.0
  P  P2  1  0.59747707  0.72152283  0.50000000  1.0
  P  P3  1  0.00000000  0.00000000  0.00000000  1.0
  P  P4  1  0.27847717  0.87595424  0.50000000  1.0
  P  P5  1  0.12404576  0.40252293  0.50000000  1.0
  P  P6  1  0.88941256  0.57209495  0.00000000  1.0
  P  P7  1  0.42790505  0.31731660  0.00000000  1.0
  P  P8  1  0.68268340  0.11058744  0.00000000  1.0
  Ru  Ru9  1  0.55723851  0.96070095  0.50000000  1.0
  Ru  Ru10  1  0.40346343  0.44276149  0.50000000  1.0
  Ru  Ru11  1  0.91656404  0.12195236  0.50000000  1.0
  Ru  Ru12  1  0.20538832  0.08343596  0.50000000  1.0
  Ru  Ru13  1  0.87804764  0.79461168  0.50000000  1.0
  Ru  Ru14  1  0.72406525  0.88632697  0.00000000  1.0
  Ru  Ru15  1  0.11367303  0.83773628  0.00000000  1.0
  Ru  Ru16  1  0.16226372  0.27593475  0.00000000  1.0
  Ru  Ru17  1  0.42737409  0.07977106  0.00000000  1.0
  Ru  Ru18  1  0.92022894  0.34760403  0.00000000  1.0
  Ru  Ru19  1  0.65239597  0.57262591  0.00000000  1.0
  Ru  Ru20  1  0.03929905  0.59653657  0.50000000  1.0