# generated using pymatgen
data_ScMo3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.86103817
_cell_length_b   5.86103817
_cell_length_c   10.21313600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000195
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScMo3O8
_chemical_formula_sum   'Sc2 Mo6 O16'
_cell_volume   303.83572588
_cell_formula_units_Z   2
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
  Sc  Sc0  1  0.66666700  0.33333300  0.00635100  1.0
  Sc  Sc1  1  0.33333300  0.66666700  0.50635100  1.0
  Mo  Mo2  1  0.30229000  0.15114500  0.75090100  1.0
  Mo  Mo3  1  0.15114500  0.84885500  0.25090100  1.0
  Mo  Mo4  1  0.84885500  0.69771000  0.75090100  1.0
  Mo  Mo5  1  0.15114500  0.30229000  0.25090100  1.0
  Mo  Mo6  1  0.69771000  0.84885500  0.25090100  1.0
  Mo  Mo7  1  0.84885500  0.15114500  0.75090100  1.0
  O  O8  1  0.83138800  0.16861200  0.13606300  1.0
  O  O9  1  0.66277600  0.83138800  0.63606300  1.0
  O  O10  1  0.16861200  0.33722400  0.63606300  1.0
  O  O11  1  0.83138800  0.66277600  0.13606300  1.0
  O  O12  1  0.33722400  0.16861200  0.13606300  1.0
  O  O13  1  0.16861200  0.83138800  0.63606300  1.0
  O  O14  1  0.51568200  0.48431800  0.86059700  1.0
  O  O15  1  0.03136400  0.51568200  0.36059700  1.0
  O  O16  1  0.48431800  0.96863600  0.36059700  1.0
  O  O17  1  0.51568200  0.03136400  0.86059700  1.0
  O  O18  1  0.00000000  0.00000000  0.38853500  1.0
  O  O19  1  0.00000000  0.00000000  0.88853500  1.0
  O  O20  1  0.33333300  0.66666700  0.15443900  1.0
  O  O21  1  0.66666700  0.33333300  0.65443900  1.0
  O  O22  1  0.48431800  0.51568200  0.36059700  1.0
  O  O23  1  0.96863600  0.48431800  0.86059700  1.0