# generated using pymatgen
data_MgSi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.74124300
_cell_length_b   7.60943518
_cell_length_c   9.97199747
_cell_angle_alpha   87.05317125
_cell_angle_beta   81.80254471
_cell_angle_gamma   79.19963181
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSi2
_chemical_formula_sum   'Mg8 Si16'
_cell_volume   423.42665809
_cell_formula_units_Z   8
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  0.72870300  0.04720000  0.69358600  1.0
  Mg  Mg1  1  0.27129700  0.95280000  0.30641400  1.0
  Mg  Mg2  1  0.21424300  0.57208700  0.03755100  1.0
  Mg  Mg3  1  0.49724500  0.30901300  0.23305800  1.0
  Mg  Mg4  1  0.13510800  0.05872800  0.86437400  1.0
  Mg  Mg5  1  0.86489200  0.94127200  0.13562600  1.0
  Mg  Mg6  1  0.50275500  0.69098700  0.76694200  1.0
  Mg  Mg7  1  0.78575700  0.42791300  0.96244900  1.0
  Si  Si8  1  0.63877900  0.38902100  0.56419100  1.0
  Si  Si9  1  0.10242600  0.22793900  0.11781900  1.0
  Si  Si10  1  0.50154000  0.83684900  0.01599500  1.0
  Si  Si11  1  0.72484600  0.07675300  0.41043200  1.0
  Si  Si12  1  0.38549700  0.36405800  0.78816000  1.0
  Si  Si13  1  0.70479100  0.76852700  0.49909600  1.0
  Si  Si14  1  0.27515400  0.92324700  0.58956800  1.0
  Si  Si15  1  0.97539700  0.32546800  0.35271200  1.0
  Si  Si16  1  0.89757400  0.77206100  0.88218100  1.0
  Si  Si17  1  0.29520900  0.23147300  0.50090400  1.0
  Si  Si18  1  0.02460300  0.67453200  0.64728800  1.0
  Si  Si19  1  0.61450300  0.63594200  0.21184000  1.0
  Si  Si20  1  0.00731000  0.35573800  0.69144400  1.0
  Si  Si21  1  0.49846000  0.16315100  0.98400500  1.0
  Si  Si22  1  0.99269000  0.64426200  0.30855600  1.0
  Si  Si23  1  0.36122100  0.61097900  0.43580900  1.0