# generated using pymatgen
data_MgSi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.92082800
_cell_length_b   6.74663930
_cell_length_c   11.51407346
_cell_angle_alpha   77.11168616
_cell_angle_beta   85.27795086
_cell_angle_gamma   86.04175435
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSi2
_chemical_formula_sum   'Mg8 Si16'
_cell_volume   446.22036942
_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  0.25802100  0.17470800  0.13019600  1.0
  Mg  Mg1  1  0.74646000  0.18173200  0.76842800  1.0
  Mg  Mg2  1  0.65100100  0.66235800  0.35576500  1.0
  Mg  Mg3  1  0.66963900  0.72412800  0.81713500  1.0
  Mg  Mg4  1  0.85334800  0.11392200  0.35616900  1.0
  Mg  Mg5  1  0.16334000  0.93490600  0.68117100  1.0
  Mg  Mg6  1  0.14255600  0.76238600  0.26052200  1.0
  Mg  Mg7  1  0.30467700  0.31182100  0.37210500  1.0
  Si  Si8  1  0.03188400  0.52822100  0.98183100  1.0
  Si  Si9  1  0.60677300  0.31295100  0.54020800  1.0
  Si  Si10  1  0.95659900  0.72594200  0.51145100  1.0
  Si  Si11  1  0.36661000  0.36104700  0.88624300  1.0
  Si  Si12  1  0.95948400  0.46246100  0.20098200  1.0
  Si  Si13  1  0.34507200  0.99487800  0.89799000  1.0
  Si  Si14  1  0.80286800  0.99496700  0.12095300  1.0
  Si  Si15  1  0.44723200  0.53261000  0.67497000  1.0
  Si  Si16  1  0.30465300  0.90096600  0.43702600  1.0
  Si  Si17  1  0.70298400  0.32577700  0.00170600  1.0
  Si  Si18  1  0.47914000  0.83266600  0.08746300  1.0
  Si  Si19  1  0.04317100  0.52236000  0.71143300  1.0
  Si  Si20  1  0.55994300  0.47433100  0.16795300  1.0
  Si  Si21  1  0.00721500  0.33273100  0.55765200  1.0
  Si  Si22  1  0.61128700  0.93517000  0.57136200  1.0
  Si  Si23  1  0.96624100  0.89723000  0.94026600  1.0