# generated using pymatgen
data_BaSmCoCuO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.93384900
_cell_length_b   3.93384900
_cell_length_c   7.73158800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaSmCoCuO6
_chemical_formula_sum   'Ba1 Sm1 Co1 Cu1 O6'
_cell_volume   119.64762286
_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
  Ba  Ba0  1  0.50000000  0.50000000  0.50162800  1.0
  Sm  Sm1  1  0.50000000  0.50000000  0.00020400  1.0
  Co  Co2  1  0.00000000  0.00000000  0.24563100  1.0
  Cu  Cu3  1  0.00000000  0.00000000  0.75380700  1.0
  O  O4  1  0.50000000  0.00000000  0.78189800  1.0
  O  O5  1  0.00000000  0.50000000  0.78189800  1.0
  O  O6  1  0.50000000  0.00000000  0.22173300  1.0
  O  O7  1  0.00000000  0.50000000  0.22173300  1.0
  O  O8  1  0.00000000  0.00000000  0.48483100  1.0
  O  O9  1  0.00000000  0.00000000  0.00663900  1.0