[CIF]
data_MoSeCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.16590961
_cell_length_b   4.49153665
_cell_length_c   5.38645305
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MoSeCl2
_chemical_formula_sum   'Mo1 Se1 Cl2'
_cell_volume   76.59427993
_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
  Cl  Cl0  1  1.58295481  0.00000000  2.69322653  1
  Cl  Cl1  1  0.00000000  0.00000000  0.00000000  1
  Mo  Mo2  1  0.00000000  2.24576832  2.69322653  1
  Se  Se3  1  1.58295481  2.24576832  0.00000000  1
[/CIF]
