# generated using pymatgen
data_MnNb3Al2C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.31319865
_cell_length_b   8.31319907
_cell_length_c   8.31319867
_cell_angle_alpha   60.00000162
_cell_angle_beta   59.99999992
_cell_angle_gamma   59.99999701
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnNb3Al2C
_chemical_formula_sum   'Mn4 Nb12 Al8 C4'
_cell_volume   406.24637200
_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
  Mn  Mn0  1  0.12500000  0.12500000  0.12500000  1.0
  Mn  Mn1  1  0.62500000  0.12500000  0.12500000  1.0
  Mn  Mn2  1  0.12500000  0.62500000  0.12500000  1.0
  Mn  Mn3  1  0.12500000  0.12500000  0.62500000  1.0
  Nb  Nb4  1  0.55824359  0.94175641  0.55824359  1.0
  Nb  Nb5  1  0.30824359  0.69175641  0.69175641  1.0
  Nb  Nb6  1  0.69175641  0.30824359  0.30824359  1.0
  Nb  Nb7  1  0.30824359  0.69175641  0.30824359  1.0
  Nb  Nb8  1  0.69175641  0.69175641  0.30824359  1.0
  Nb  Nb9  1  0.30824359  0.30824359  0.69175641  1.0
  Nb  Nb10  1  0.55824359  0.55824359  0.94175641  1.0
  Nb  Nb11  1  0.94175641  0.55824359  0.55824359  1.0
  Nb  Nb12  1  0.55824359  0.94175641  0.94175641  1.0
  Nb  Nb13  1  0.94175641  0.94175641  0.55824359  1.0
  Nb  Nb14  1  0.69175641  0.30824359  0.69175641  1.0
  Nb  Nb15  1  0.94175641  0.55824359  0.94175641  1.0
  Al  Al16  1  0.91595081  0.91595081  0.91595081  1.0
  Al  Al17  1  0.99785243  0.33404919  0.33404919  1.0
  Al  Al18  1  0.33404919  0.99785243  0.33404919  1.0
  Al  Al19  1  0.33404919  0.33404919  0.99785243  1.0
  Al  Al20  1  0.91595081  0.25214757  0.91595081  1.0
  Al  Al21  1  0.91595081  0.91595081  0.25214757  1.0
  Al  Al22  1  0.25214757  0.91595081  0.91595081  1.0
  Al  Al23  1  0.33404919  0.33404919  0.33404919  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