# generated using pymatgen
data_SmEr3(Sc3Sn4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.72563453
_cell_length_b   7.85405591
_cell_length_c   14.87546437
_cell_angle_alpha   89.98552698
_cell_angle_beta   89.39615351
_cell_angle_gamma   90.36990788
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmEr3(Sc3Sn4)2
_chemical_formula_sum   'Sm2 Er6 Sc12 Sn16'
_cell_volume   902.53798084
_cell_formula_units_Z   2
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  0.98895466  0.17848623  0.09525943  1.0
  Sm  Sm1  1  0.01104534  0.82151377  0.90474057  1.0
  Er  Er2  1  0.51620956  0.67447822  0.90324863  1.0
  Er  Er3  1  0.01874127  0.82048418  0.59625071  1.0
  Er  Er4  1  0.48379044  0.32552178  0.09675137  1.0
  Er  Er5  1  0.98125873  0.17951582  0.40374929  1.0
  Er  Er6  1  0.48322012  0.32083097  0.40521920  1.0
  Er  Er7  1  0.51677988  0.67916903  0.59478080  1.0
  Sc  Sc8  1  0.18626432  0.49492583  0.74831862  1.0
  Sc  Sc9  1  0.81373568  0.50507417  0.25168138  1.0
  Sc  Sc10  1  0.31430588  0.99442279  0.25241994  1.0
  Sc  Sc11  1  0.68569412  0.00557721  0.74758006  1.0
  Sc  Sc12  1  0.35768192  0.15939283  0.62441911  1.0
  Sc  Sc13  1  0.64231808  0.84060717  0.37558089  1.0
  Sc  Sc14  1  0.14396326  0.65946425  0.37699528  1.0
  Sc  Sc15  1  0.64867220  0.83627069  0.12737353  1.0
  Sc  Sc16  1  0.85603674  0.34053575  0.62300472  1.0
  Sc  Sc17  1  0.35132780  0.16372931  0.87262647  1.0
  Sc  Sc18  1  0.85267183  0.33981605  0.87487325  1.0
  Sc  Sc19  1  0.14732817  0.66018395  0.12512675  1.0
  Sn  Sn20  1  0.04824011  0.12900634  0.74905277  1.0
  Sn  Sn21  1  0.95175989  0.87099366  0.25094723  1.0
  Sn  Sn22  1  0.44937840  0.62643100  0.25165568  1.0
  Sn  Sn23  1  0.55062160  0.37356900  0.74834432  1.0
  Sn  Sn24  1  0.32494700  0.85056551  0.74975241  1.0
  Sn  Sn25  1  0.67505300  0.14943449  0.25024759  1.0
  Sn  Sn26  1  0.17864663  0.35242668  0.25154131  1.0
  Sn  Sn27  1  0.82135337  0.64757332  0.74845869  1.0
  Sn  Sn28  1  0.19922336  0.45563947  0.54240266  1.0
  Sn  Sn29  1  0.80077664  0.54436053  0.45759734  1.0
  Sn  Sn30  1  0.30012312  0.95924905  0.45781659  1.0
  Sn  Sn31  1  0.80325850  0.54404530  0.04209847  1.0
  Sn  Sn32  1  0.69987688  0.04075095  0.54218341  1.0
  Sn  Sn33  1  0.19674150  0.45595470  0.95790153  1.0
  Sn  Sn34  1  0.68179840  0.04223469  0.95758519  1.0
  Sn  Sn35  1  0.31820160  0.95776531  0.04241481  1.0