# generated using pymatgen
data_Mg2Sc(Co3B2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.64386827
_cell_length_b   5.64386913
_cell_length_c   5.64386832
_cell_angle_alpha   95.84035338
_cell_angle_beta   95.84036271
_cell_angle_gamma   95.84036723
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2Sc(Co3B2)3
_chemical_formula_sum   'Mg2 Sc1 Co9 B6'
_cell_volume   176.76877514
_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
  Mg  Mg0  1  0.99715071  0.99715071  0.99715071  1.0
  Mg  Mg1  1  0.67454367  0.67454367  0.67454367  1.0
  Sc  Sc2  1  0.32921287  0.32921287  0.32921287  1.0
  Co  Co3  1  0.99717970  0.99717970  0.50055607  1.0
  Co  Co4  1  0.50055607  0.99717970  0.99717970  1.0
  Co  Co5  1  0.99717970  0.50055607  0.99717970  1.0
  Co  Co6  1  0.70397324  0.20637085  0.70397324  1.0
  Co  Co7  1  0.70397324  0.70397324  0.20637085  1.0
  Co  Co8  1  0.20637085  0.70397324  0.70397324  1.0
  Co  Co9  1  0.29424097  0.79928649  0.29424097  1.0
  Co  Co10  1  0.29424097  0.29424097  0.79928649  1.0
  Co  Co11  1  0.79928649  0.29424097  0.29424097  1.0
  B  B12  1  0.61306618  0.38776255  0.00021754  1.0
  B  B13  1  0.00021754  0.61306618  0.38776255  1.0
  B  B14  1  0.38776255  0.00021754  0.61306618  1.0
  B  B15  1  0.00021754  0.38776255  0.61306618  1.0
  B  B16  1  0.61306618  0.00021754  0.38776255  1.0
  B  B17  1  0.38776255  0.61306618  0.00021754  1.0