# generated using pymatgen
data_Zr3NbC4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.92903749
_cell_length_b   10.92903749
_cell_length_c   10.92903727
_cell_angle_alpha   17.31707424
_cell_angle_beta   17.31707424
_cell_angle_gamma   17.31706867
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3NbC4
_chemical_formula_sum   'Zr3 Nb1 C4'
_cell_volume   100.92724812
_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  0.25116470  0.25116470  0.25116470  1.0
  Zr  Zr1  1  0.50000000  0.50000000  0.50000000  1.0
  Zr  Zr2  1  0.74883530  0.74883530  0.74883530  1.0
  Nb  Nb3  1  0.00000000  0.00000000  0.00000000  1.0
  C  C4  1  0.37260303  0.37260303  0.37260303  1.0
  C  C5  1  0.12413548  0.12413548  0.12413548  1.0
  C  C6  1  0.62739697  0.62739697  0.62739697  1.0
  C  C7  1  0.87586452  0.87586452  0.87586452  1.0