# generated using pymatgen
data_Er(Mo3Se4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.77849604
_cell_length_b   6.77849604
_cell_length_c   6.77849538
_cell_angle_alpha   89.37402051
_cell_angle_beta   89.37402051
_cell_angle_gamma   89.37402665
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er(Mo3Se4)2
_chemical_formula_sum   'Er1 Mo6 Se8'
_cell_volume   311.40300190
_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  0.00000000  0.00000000  0.00000000  1.0
  Mo  Mo1  1  0.76713900  0.57676900  0.44185100  1.0
  Mo  Mo2  1  0.44185100  0.76713900  0.57676900  1.0
  Mo  Mo3  1  0.57676900  0.44185100  0.76713900  1.0
  Mo  Mo4  1  0.23286100  0.42323100  0.55814900  1.0
  Mo  Mo5  1  0.55814900  0.23286100  0.42323100  1.0
  Mo  Mo6  1  0.42323100  0.55814900  0.23286100  1.0
  Se  Se7  1  0.76434200  0.76434200  0.76434200  1.0
  Se  Se8  1  0.23565800  0.23565800  0.23565800  1.0
  Se  Se9  1  0.24377100  0.63161900  0.87692300  1.0
  Se  Se10  1  0.87692300  0.24377100  0.63161900  1.0
  Se  Se11  1  0.63161900  0.87692300  0.24377100  1.0
  Se  Se12  1  0.75622900  0.36838100  0.12307700  1.0
  Se  Se13  1  0.12307700  0.75622900  0.36838100  1.0
  Se  Se14  1  0.36838100  0.12307700  0.75622900  1.0