# generated using pymatgen
data_NiSbSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.10001406
_cell_length_b   6.10010336
_cell_length_c   6.09994178
_cell_angle_alpha   89.99860387
_cell_angle_beta   90.00059531
_cell_angle_gamma   89.99863450
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiSbSe
_chemical_formula_sum   'Ni4 Sb4 Se4'
_cell_volume   226.98320273
_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
  Ni  Ni0  1  0.99169417  0.99169361  0.99169156  1.0
  Ni  Ni1  1  0.50832054  0.00831468  0.49168851  1.0
  Ni  Ni2  1  0.49167550  0.50831551  0.00831329  1.0
  Ni  Ni3  1  0.00829698  0.49168324  0.50831467  1.0
  Sb  Sb4  1  0.37007675  0.12994226  0.87006527  1.0
  Sb  Sb5  1  0.87007071  0.37004301  0.12995923  1.0
  Sb  Sb6  1  0.62994195  0.62993845  0.62993152  1.0
  Sb  Sb7  1  0.12993588  0.87006396  0.37004584  1.0
  Se  Se8  1  0.87685898  0.12314797  0.62315197  1.0
  Se  Se9  1  0.12313205  0.62315552  0.87684371  1.0
  Se  Se10  1  0.62316379  0.87685356  0.12314488  1.0
  Se  Se11  1  0.37683269  0.37684722  0.37684956  1.0