# generated using pymatgen
data_SmMn4(CuO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.44108473
_cell_length_b   6.44108473
_cell_length_c   6.44108473
_cell_angle_alpha   109.47122063
_cell_angle_beta   109.47122063
_cell_angle_gamma   109.47122063
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmMn4(CuO4)3
_chemical_formula_sum   'Sm1 Mn4 Cu3 O12'
_cell_volume   205.70987714
_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
  Sm  Sm0  1  0.00000000  0.00000000  0.00000000  1.0
  Mn  Mn1  1  0.50000000  0.50000000  0.50000000  1.0
  Mn  Mn2  1  0.50000000  0.00000000  0.00000000  1.0
  Mn  Mn3  1  0.00000000  0.00000000  0.50000000  1.0
  Mn  Mn4  1  0.00000000  0.50000000  0.00000000  1.0
  Cu  Cu5  1  0.00000000  0.50000000  0.50000000  1.0
  Cu  Cu6  1  0.50000000  0.50000000  0.00000000  1.0
  Cu  Cu7  1  0.50000000  0.00000000  0.50000000  1.0
  O  O8  1  0.82973500  0.13422200  0.30448700  1.0
  O  O9  1  0.47475200  0.30448700  0.17026500  1.0
  O  O10  1  0.30448700  0.17026500  0.47475200  1.0
  O  O11  1  0.17026500  0.47475200  0.30448700  1.0
  O  O12  1  0.69551300  0.82973500  0.52524800  1.0
  O  O13  1  0.69551300  0.17026500  0.86577800  1.0
  O  O14  1  0.52524800  0.69551300  0.82973500  1.0
  O  O15  1  0.17026500  0.86577800  0.69551300  1.0
  O  O16  1  0.30448700  0.82973500  0.13422200  1.0
  O  O17  1  0.82973500  0.52524800  0.69551300  1.0
  O  O18  1  0.13422200  0.30448700  0.82973500  1.0
  O  O19  1  0.86577800  0.69551300  0.17026500  1.0