# generated using pymatgen
data_ZrNb3C4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.71246335
_cell_length_b   10.71246335
_cell_length_c   10.71246293
_cell_angle_alpha   17.28139472
_cell_angle_beta   17.28139472
_cell_angle_gamma   17.28139448
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrNb3C4
_chemical_formula_sum   'Zr1 Nb3 C4'
_cell_volume   94.66307850
_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  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb1  1  0.24826500  0.24826500  0.24826500  1.0
  Nb  Nb2  1  0.50000000  0.50000000  0.50000000  1.0
  Nb  Nb3  1  0.75173500  0.75173500  0.75173500  1.0
  C  C4  1  0.37771100  0.37771100  0.37771100  1.0
  C  C5  1  0.12577200  0.12577200  0.12577200  1.0
  C  C6  1  0.62228900  0.62228900  0.62228900  1.0
  C  C7  1  0.87422800  0.87422800  0.87422800  1.0