# generated using pymatgen
data_Nb3Ga2RuC
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.29914566
_cell_length_b   8.29914590
_cell_length_c   8.29914450
_cell_angle_alpha   60.00000559
_cell_angle_beta   60.00000463
_cell_angle_gamma   59.99999949
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb3Ga2RuC
_chemical_formula_sum   'Nb12 Ga8 Ru4 C4'
_cell_volume   404.18961200
_cell_formula_units_Z   4
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  0.69382408  0.30617592  0.69382408  1.0
  Nb  Nb1  1  0.94382408  0.55617592  0.55617592  1.0
  Nb  Nb2  1  0.55617592  0.94382408  0.94382408  1.0
  Nb  Nb3  1  0.94382408  0.55617592  0.94382408  1.0
  Nb  Nb4  1  0.55617592  0.55617592  0.94382408  1.0
  Nb  Nb5  1  0.94382408  0.94382408  0.55617592  1.0
  Nb  Nb6  1  0.69382408  0.69382408  0.30617592  1.0
  Nb  Nb7  1  0.30617592  0.69382408  0.69382408  1.0
  Nb  Nb8  1  0.69382408  0.30617592  0.30617592  1.0
  Nb  Nb9  1  0.30617592  0.30617592  0.69382408  1.0
  Nb  Nb10  1  0.55617592  0.94382408  0.55617592  1.0
  Nb  Nb11  1  0.30617592  0.69382408  0.30617592  1.0
  Ga  Ga12  1  0.33532475  0.33532475  0.33532475  1.0
  Ga  Ga13  1  0.25597224  0.91467525  0.91467525  1.0
  Ga  Ga14  1  0.91467525  0.25597224  0.91467525  1.0
  Ga  Ga15  1  0.91467525  0.91467525  0.25597224  1.0
  Ga  Ga16  1  0.33532475  0.99402776  0.33532475  1.0
  Ga  Ga17  1  0.33532475  0.33532475  0.99402776  1.0
  Ga  Ga18  1  0.99402776  0.33532475  0.33532475  1.0
  Ga  Ga19  1  0.91467525  0.91467525  0.91467525  1.0
  Ru  Ru20  1  0.12500000  0.12500000  0.12500000  1.0
  Ru  Ru21  1  0.62500000  0.12500000  0.12500000  1.0
  Ru  Ru22  1  0.12500000  0.62500000  0.12500000  1.0
  Ru  Ru23  1  0.12500000  0.12500000  0.62500000  1.0
  C  C24  1  0.62500000  0.62500000  0.62500000  1.0
  C  C25  1  0.12500000  0.62500000  0.62500000  1.0
  C  C26  1  0.62500000  0.12500000  0.62500000  1.0
  C  C27  1  0.62500000  0.62500000  0.12500000  1.0