# generated using pymatgen
data_Er3P2Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.90118163
_cell_length_b   6.90118148
_cell_length_c   6.90118164
_cell_angle_alpha   146.58604577
_cell_angle_beta   131.93771260
_cell_angle_gamma   59.79893051
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er3P2Se
_chemical_formula_sum   'Er3 P2 Se1'
_cell_volume   133.42786047
_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  0.50000000  0.00000000  0.50000000  1.0
  Er  Er1  1  0.17749354  0.67749354  0.50000000  1.0
  Er  Er2  1  0.82250646  0.32250646  0.50000000  1.0
  P  P3  1  0.66414564  0.66414564  0.00000000  1.0
  P  P4  1  0.33585436  0.33585436  1.00000000  1.0
  Se  Se5  1  0.00000000  0.00000000  0.00000000  1.0