# generated using pymatgen
data_Nb4TcP4Ru3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.74708460
_cell_length_b   6.36275004
_cell_length_c   7.18800669
_cell_angle_alpha   90.12833095
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb4TcP4Ru3
_chemical_formula_sum   'Nb4 Tc1 P4 Ru3'
_cell_volume   171.37432020
_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
  Nb  Nb0  1  0.25000000  0.02413832  0.82694798  1.0
  Nb  Nb1  1  0.25000000  0.52286985  0.67182428  1.0
  Nb  Nb2  1  0.75000000  0.97922293  0.17244631  1.0
  Nb  Nb3  1  0.75000000  0.47387825  0.32792995  1.0
  Tc  Tc4  1  0.25000000  0.14635241  0.44084808  1.0
  P  P5  1  0.25000000  0.27457161  0.12367826  1.0
  P  P6  1  0.25000000  0.77304122  0.37486705  1.0
  P  P7  1  0.75000000  0.72834270  0.87634131  1.0
  P  P8  1  0.75000000  0.22641719  0.62479630  1.0
  Ru  Ru9  1  0.25000000  0.64668731  0.06124795  1.0
  Ru  Ru10  1  0.75000000  0.84987335  0.56168437  1.0
  Ru  Ru11  1  0.75000000  0.35460588  0.93738917  1.0