[CIF]
data_GeMoSe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.65027724
_cell_length_b   5.65027724
_cell_length_c   5.65027724
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GeMoSe4
_chemical_formula_sum   'Ge1 Mo1 Se4'
_cell_volume   127.55405648
_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
  Ge  Ge0  1  0.00000000  0.00000000  0.00000000  1
  Mo  Mo1  1  1.99767468  1.99767468  1.99767468  1
  Se  Se2  1  3.00341843  3.00341843  4.98728027  1
  Se  Se3  1  3.00341843  4.98728027  3.00341843  1
  Se  Se4  1  4.98728027  3.00341843  3.00341843  1
  Se  Se5  1  4.98728027  4.98728027  4.98728027  1
[/CIF]
