# generated using pymatgen
data_Mg2ScNi7B2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.87665634
_cell_length_b   4.87665734
_cell_length_c   7.37531124
_cell_angle_alpha   109.35100880
_cell_angle_beta   109.35101685
_cell_angle_gamma   60.03388719
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2ScNi7B2
_chemical_formula_sum   'Mg2 Sc1 Ni7 B2'
_cell_volume   140.38459745
_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  0.35415064  0.35415064  0.06178598  1.0
  Mg  Mg1  1  0.64584936  0.64584936  0.93821402  1.0
  Sc  Sc2  1  0.50000000  0.50000000  0.50000100  1.0
  Ni  Ni3  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni4  1  0.93211675  0.93211675  0.29326059  1.0
  Ni  Ni5  1  0.93209454  0.42891134  0.29268153  1.0
  Ni  Ni6  1  0.42891134  0.93209454  0.29268153  1.0
  Ni  Ni7  1  0.57108766  0.06790446  0.70731847  1.0
  Ni  Ni8  1  0.06790446  0.57108766  0.70731847  1.0
  Ni  Ni9  1  0.06788225  0.06788225  0.70673941  1.0
  B  B10  1  0.83263345  0.83263345  0.49949414  1.0
  B  B11  1  0.16736555  0.16736555  0.50050586  1.0