# generated using pymatgen
data_Sm2MgCuO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.08970403
_cell_length_b   4.08971550
_cell_length_c   8.85009171
_cell_angle_alpha   103.31164946
_cell_angle_beta   103.35916519
_cell_angle_gamma   90.00000529
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm2MgCuO4
_chemical_formula_sum   'Sm2 Mg1 Cu1 O4'
_cell_volume   139.92789057
_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  0.68800600  0.68823200  0.37601300  1.0
  Sm  Sm1  1  0.31199400  0.31177000  0.62398800  1.0
  Mg  Mg2  1  0.50000000  0.50000000  0.00000000  1.0
  Cu  Cu3  1  0.00000000  0.00000000  0.00000000  1.0
  O  O4  1  0.24999900  0.74981700  0.49999800  1.0
  O  O5  1  0.75000100  0.25018100  0.50000100  1.0
  O  O6  1  0.00000000  0.50000000  0.00000000  1.0
  O  O7  1  0.50000000  0.00000000  0.00000000  1.0