# generated using pymatgen
data_Er4Th(MnB3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.39588473
_cell_length_b   5.39588499
_cell_length_c   8.22277651
_cell_angle_alpha   70.84614395
_cell_angle_beta   70.84614086
_cell_angle_gamma   59.99998199
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er4Th(MnB3)2
_chemical_formula_sum   'Er4 Th1 Mn2 B6'
_cell_volume   191.87943343
_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
  Er  Er0  1  0.25036936  0.25036936  0.24889092  1.0
  Er  Er1  1  0.74963064  0.74963064  0.75110908  1.0
  Er  Er2  1  0.41641674  0.41641674  0.75075177  1.0
  Er  Er3  1  0.58358326  0.58358326  0.24924823  1.0
  Th  Th4  1  0.00000000  0.00000000  0.00000000  1.0
  Mn  Mn5  1  0.11297686  0.11297686  0.66107043  1.0
  Mn  Mn6  1  0.88702314  0.88702314  0.33892957  1.0
  B  B7  1  0.16636633  0.83363367  0.50000000  1.0
  B  B8  1  0.83363367  0.50000000  0.50000000  1.0
  B  B9  1  0.50000000  0.16636633  0.50000000  1.0
  B  B10  1  0.16636633  0.50000000  0.50000000  1.0
  B  B11  1  0.50000000  0.83363367  0.50000000  1.0
  B  B12  1  0.83363367  0.16636633  0.50000000  1.0