# generated using pymatgen
data_Nb3Al2CrC
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.33881052
_cell_length_b   8.33881075
_cell_length_c   8.33881010
_cell_angle_alpha   60.00000257
_cell_angle_beta   60.00000168
_cell_angle_gamma   60.00000662
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb3Al2CrC
_chemical_formula_sum   'Nb12 Al8 Cr4 C4'
_cell_volume   410.01273383
_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  0.55763565  0.94236435  0.55763565  1.0
  Nb  Nb1  1  0.30763565  0.69236435  0.69236435  1.0
  Nb  Nb2  1  0.69236435  0.30763565  0.30763565  1.0
  Nb  Nb3  1  0.30763565  0.69236435  0.30763565  1.0
  Nb  Nb4  1  0.69236435  0.69236435  0.30763565  1.0
  Nb  Nb5  1  0.30763565  0.30763565  0.69236435  1.0
  Nb  Nb6  1  0.55763565  0.55763565  0.94236435  1.0
  Nb  Nb7  1  0.94236435  0.55763565  0.55763565  1.0
  Nb  Nb8  1  0.55763565  0.94236435  0.94236435  1.0
  Nb  Nb9  1  0.94236435  0.94236435  0.55763565  1.0
  Nb  Nb10  1  0.69236435  0.30763565  0.69236435  1.0
  Nb  Nb11  1  0.94236435  0.55763565  0.94236435  1.0
  Al  Al12  1  0.91540333  0.91540333  0.91540333  1.0
  Al  Al13  1  0.99620700  0.33459667  0.33459667  1.0
  Al  Al14  1  0.33459667  0.99620700  0.33459667  1.0
  Al  Al15  1  0.33459667  0.33459667  0.99620700  1.0
  Al  Al16  1  0.91540333  0.25379300  0.91540333  1.0
  Al  Al17  1  0.91540333  0.91540333  0.25379300  1.0
  Al  Al18  1  0.25379300  0.91540333  0.91540333  1.0
  Al  Al19  1  0.33459667  0.33459667  0.33459667  1.0
  Cr  Cr20  1  0.12500000  0.12500000  0.12500000  1.0
  Cr  Cr21  1  0.62500000  0.12500000  0.12500000  1.0
  Cr  Cr22  1  0.12500000  0.62500000  0.12500000  1.0
  Cr  Cr23  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