# generated using pymatgen
data_SmCO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.93787200
_cell_length_b   7.24591600
_cell_length_c   8.42993100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmCO4
_chemical_formula_sum   'Sm4 C4 O16'
_cell_volume   301.61792153
_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
  Sm  Sm0  1  0.25000000  0.35748700  0.33452200  1.0
  Sm  Sm1  1  0.25000000  0.85748700  0.16547800  1.0
  Sm  Sm2  1  0.75000000  0.64251300  0.66547800  1.0
  Sm  Sm3  1  0.75000000  0.14251300  0.83452200  1.0
  C  C4  1  0.25000000  0.30086800  0.67797000  1.0
  C  C5  1  0.25000000  0.80086800  0.82203000  1.0
  C  C6  1  0.75000000  0.69913200  0.32203000  1.0
  C  C7  1  0.75000000  0.19913200  0.17797000  1.0
  O  O8  1  0.25000000  0.03853400  0.39669900  1.0
  O  O9  1  0.25000000  0.53853400  0.10330100  1.0
  O  O10  1  0.75000000  0.96146600  0.60330100  1.0
  O  O11  1  0.75000000  0.46146600  0.89669900  1.0
  O  O12  1  0.75000000  0.29640200  0.30483300  1.0
  O  O13  1  0.75000000  0.79640200  0.19516700  1.0
  O  O14  1  0.25000000  0.70359800  0.69516700  1.0
  O  O15  1  0.25000000  0.20359800  0.80483300  1.0
  O  O16  1  0.97751900  0.65299100  0.38904200  1.0
  O  O17  1  0.52248100  0.15299100  0.11095800  1.0
  O  O18  1  0.47751900  0.34700900  0.61095800  1.0
  O  O19  1  0.02248100  0.84700900  0.88904200  1.0
  O  O20  1  0.02248100  0.34700900  0.61095800  1.0
  O  O21  1  0.47751900  0.84700900  0.88904200  1.0
  O  O22  1  0.52248100  0.65299100  0.38904200  1.0
  O  O23  1  0.97751900  0.15299100  0.11095800  1.0