# generated using pymatgen
data_Mg2ScTa7B20
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.13742268
_cell_length_b   7.00989312
_cell_length_c   7.41655746
_cell_angle_alpha   94.45302479
_cell_angle_beta   101.92726855
_cell_angle_gamma   115.94438431
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2ScTa7B20
_chemical_formula_sum   'Mg2 Sc1 Ta7 B20'
_cell_volume   275.55929532
_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  0.49644446  0.99659577  0.99688880  1.0
  Mg  Mg1  1  0.00284207  0.60500335  0.80303951  1.0
  Sc  Sc2  1  0.99935210  0.99790345  0.99993654  1.0
  Ta  Ta3  1  0.49778296  0.79474748  0.40020073  1.0
  Ta  Ta4  1  0.99854325  0.39625921  0.20361335  1.0
  Ta  Ta5  1  0.50226009  0.20495268  0.59743778  1.0
  Ta  Ta6  1  0.00106560  0.80205138  0.39990586  1.0
  Ta  Ta7  1  0.50015578  0.60192937  0.79893088  1.0
  Ta  Ta8  1  0.49877011  0.39622917  0.20099415  1.0
  Ta  Ta9  1  0.00137625  0.20452707  0.59903446  1.0
  B  B10  1  0.33450940  0.23225427  0.86792354  1.0
  B  B11  1  0.33177717  0.63189479  0.06693140  1.0
  B  B12  1  0.16673473  0.36796583  0.93283966  1.0
  B  B13  1  0.33400620  0.03143838  0.26490069  1.0
  B  B14  1  0.16787261  0.76501738  0.13397177  1.0
  B  B15  1  0.83251356  0.23402914  0.86506173  1.0
  B  B16  1  0.16630094  0.16552079  0.33299676  1.0
  B  B17  1  0.83334360  0.63106398  0.06641002  1.0
  B  B18  1  0.33362548  0.43393779  0.46609957  1.0
  B  B19  1  0.66667127  0.36647440  0.93394180  1.0
  B  B20  1  0.82959430  0.03046382  0.26488539  1.0
  B  B21  1  0.66486470  0.76613956  0.13244799  1.0
  B  B22  1  0.33267900  0.83497768  0.66619278  1.0
  B  B23  1  0.16684776  0.56823547  0.53687228  1.0
  B  B24  1  0.66568461  0.16488364  0.33352604  1.0
  B  B25  1  0.83484600  0.43500638  0.46923181  1.0
  B  B26  1  0.16793294  0.96788294  0.73132621  1.0
  B  B27  1  0.83486674  0.83413199  0.66633318  1.0
  B  B28  1  0.67010994  0.56910762  0.53525555  1.0
  B  B29  1  0.66662640  0.96937025  0.73286975  1.0