# generated using pymatgen
data_Er(NbSe2)5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.10305412
_cell_length_b   8.00284298
_cell_length_c   8.78886330
_cell_angle_alpha   112.96881602
_cell_angle_beta   96.88938471
_cell_angle_gamma   104.44838658
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er(NbSe2)5
_chemical_formula_sum   'Er1 Nb5 Se10'
_cell_volume   371.18761022
_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  0.66798614  0.50827007  0.99503071  1.0
  Nb  Nb1  1  0.00298143  0.99697159  0.00035181  1.0
  Nb  Nb2  1  0.59879118  0.20527560  0.20243686  1.0
  Nb  Nb3  1  0.19885812  0.39978417  0.39868216  1.0
  Nb  Nb4  1  0.79610200  0.59941266  0.60243974  1.0
  Nb  Nb5  1  0.40134600  0.79517790  0.79861427  1.0
  Se  Se6  1  0.23664049  0.05750728  0.29483218  1.0
  Se  Se7  1  0.04661522  0.65216929  0.89651593  1.0
  Se  Se8  1  0.83503898  0.25658722  0.49315990  1.0
  Se  Se9  1  0.63592814  0.86578619  0.10518746  1.0
  Se  Se10  1  0.42413988  0.44173999  0.68643639  1.0
  Se  Se11  1  0.90216507  0.55259784  0.31072857  1.0
  Se  Se12  1  0.69895871  0.13841458  0.90131016  1.0
  Se  Se13  1  0.49777718  0.74339602  0.50676826  1.0
  Se  Se14  1  0.29019324  0.34466908  0.10230612  1.0
  Se  Se15  1  0.09927821  0.93983952  0.70679946  1.0