# generated using pymatgen
data_MgSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.47217900
_cell_length_b   5.92829261
_cell_length_c   13.86498459
_cell_angle_alpha   82.70734411
_cell_angle_beta   84.99790528
_cell_angle_gamma   88.32284955
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSi
_chemical_formula_sum   'Mg12 Si12'
_cell_volume   444.37647884
_cell_formula_units_Z   12
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  0.74355800  0.49043600  0.72867500  1.0
  Mg  Mg1  1  0.69269800  0.56999600  0.40676400  1.0
  Mg  Mg2  1  0.48791100  0.72614500  0.06636400  1.0
  Mg  Mg3  1  0.88827000  0.98817200  0.73276800  1.0
  Mg  Mg4  1  0.64716900  0.06999700  0.40409700  1.0
  Mg  Mg5  1  0.97837800  0.22310400  0.06575700  1.0
  Mg  Mg6  1  0.35283100  0.93000300  0.59590300  1.0
  Mg  Mg7  1  0.25644200  0.50956400  0.27132500  1.0
  Mg  Mg8  1  0.51208900  0.27385500  0.93363600  1.0
  Mg  Mg9  1  0.30730200  0.43000400  0.59323600  1.0
  Mg  Mg10  1  0.11173000  0.01182800  0.26723200  1.0
  Mg  Mg11  1  0.02162200  0.77689600  0.93424300  1.0
  Si  Si12  1  0.25511000  0.61097100  0.77048000  1.0
  Si  Si13  1  0.17553100  0.75436400  0.43801000  1.0
  Si  Si14  1  0.97858300  0.71688900  0.12921700  1.0
  Si  Si15  1  0.36124400  0.12687600  0.76715300  1.0
  Si  Si16  1  0.16231000  0.20824800  0.43614400  1.0
  Si  Si17  1  0.46157600  0.21508200  0.13064400  1.0
  Si  Si18  1  0.82446900  0.24563600  0.56199000  1.0
  Si  Si19  1  0.63875600  0.87312400  0.23284700  1.0
  Si  Si20  1  0.02141700  0.28311100  0.87078300  1.0
  Si  Si21  1  0.83769000  0.79175200  0.56385600  1.0
  Si  Si22  1  0.74489000  0.38902900  0.22952000  1.0
  Si  Si23  1  0.53842400  0.78491800  0.86935600  1.0