# generated using pymatgen
data_Zr3Ga2BRu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.95609844
_cell_length_b   6.95612281
_cell_length_c   3.29849619
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99948692
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3Ga2BRu3
_chemical_formula_sum   'Zr3 Ga2 B1 Ru3'
_cell_volume   138.22348062
_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
  Zr  Zr0  1  0.38327260  0.38327649  0.50000000  1.0
  Zr  Zr1  1  0.61670169  0.00002158  0.50000000  1.0
  Zr  Zr2  1  0.00000910  0.61669239  0.50000000  1.0
  Ga  Ga3  1  0.66666550  0.33333343  0.00000000  1.0
  Ga  Ga4  1  0.33334286  0.66667121  0.00000000  1.0
  B  B5  1  0.00000548  0.00000876  0.50000000  1.0
  Ru  Ru6  1  0.99999577  0.23240790  0.00000000  1.0
  Ru  Ru7  1  0.23242454  0.00000052  0.00000000  1.0
  Ru  Ru8  1  0.76758247  0.76758771  0.00000000  1.0