[CIF]
data_Sc2Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.50769621
_cell_length_b   6.50769621
_cell_length_c   6.50769621
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2Mo
_chemical_formula_sum   'Sc8 Mo4'
_cell_volume   275.60165009
_cell_formula_units_Z   4
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
  Mo  Mo0  1  0.00000000  0.00000000  0.00000000  1
  Mo  Mo1  1  0.00000000  3.25384811  3.25384811  1
  Mo  Mo2  1  3.25384811  0.00000000  3.25384811  1
  Mo  Mo3  1  3.25384811  3.25384811  0.00000000  1
  Sc  Sc4  1  1.05312356  4.30697166  5.45457265  1
  Sc  Sc5  1  1.05312356  5.45457265  2.20072455  1
  Sc  Sc6  1  2.20072455  1.05312356  5.45457265  1
  Sc  Sc7  1  2.20072455  2.20072455  2.20072455  1
  Sc  Sc8  1  4.30697166  4.30697166  4.30697166  1
  Sc  Sc9  1  4.30697166  5.45457265  1.05312356  1
  Sc  Sc10  1  5.45457265  1.05312356  4.30697166  1
  Sc  Sc11  1  5.45457265  2.20072455  1.05312356  1
[/CIF]
