# generated using pymatgen
data_Nb7(B2C)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.76258740
_cell_length_b   16.76258740
_cell_length_c   3.26336600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   169.22112723
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb7(B2C)3
_chemical_formula_sum   'Nb7 B6 C3'
_cell_volume   171.48804231
_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
  Nb  Nb0  1  0.70950400  0.29049600  0.00000000  1.0
  Nb  Nb1  1  0.29049600  0.70950400  0.00000000  1.0
  Nb  Nb2  1  0.56715200  0.43284800  0.50000000  1.0
  Nb  Nb3  1  0.43284800  0.56715200  0.50000000  1.0
  Nb  Nb4  1  0.13059100  0.86940900  0.00000000  1.0
  Nb  Nb5  1  0.86940900  0.13059100  0.00000000  1.0
  Nb  Nb6  1  0.00000000  0.00000000  0.00000000  1.0
  B  B7  1  0.65247600  0.34752400  0.50000000  1.0
  B  B8  1  0.34752400  0.65247600  0.50000000  1.0
  B  B9  1  0.76345100  0.23654900  0.50000000  1.0
  B  B10  1  0.23654900  0.76345100  0.50000000  1.0
  B  B11  1  0.18159500  0.81840500  0.50000000  1.0
  B  B12  1  0.81840500  0.18159500  0.50000000  1.0
  C  C13  1  0.06612200  0.93387800  0.00000000  1.0
  C  C14  1  0.50000000  0.50000000  0.50000000  1.0
  C  C15  1  0.93387800  0.06612200  0.00000000  1.0