# generated using pymatgen
data_MgSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33127300
_cell_length_b   6.22879672
_cell_length_c   14.28634748
_cell_angle_alpha   100.81517776
_cell_angle_beta   88.55474164
_cell_angle_gamma   103.49596333
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSi
_chemical_formula_sum   'Mg12 Si12'
_cell_volume   453.03275065
_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  0.12693000  0.60139000  0.26384200  1.0
  Mg  Mg1  1  0.36631000  0.69327400  0.58026200  1.0
  Mg  Mg2  1  0.71110900  0.66885600  0.94389200  1.0
  Mg  Mg3  1  0.06970600  0.09884600  0.26922700  1.0
  Mg  Mg4  1  0.34882700  0.21630300  0.61900800  1.0
  Mg  Mg5  1  0.76559300  0.17191400  0.92263900  1.0
  Mg  Mg6  1  0.63369000  0.30672600  0.41973800  1.0
  Mg  Mg7  1  0.93029400  0.90115400  0.73077300  1.0
  Mg  Mg8  1  0.23440700  0.82808600  0.07736100  1.0
  Mg  Mg9  1  0.65117300  0.78369700  0.38099200  1.0
  Mg  Mg10  1  0.87307000  0.39861000  0.73615800  1.0
  Mg  Mg11  1  0.28889100  0.33114400  0.05610800  1.0
  Si  Si12  1  0.54421300  0.99588400  0.23607700  1.0
  Si  Si13  1  0.81804400  0.10719700  0.56618000  1.0
  Si  Si14  1  0.19337700  0.96825700  0.90425400  1.0
  Si  Si15  1  0.55054200  0.40209800  0.23780900  1.0
  Si  Si16  1  0.87468500  0.71086600  0.54275600  1.0
  Si  Si17  1  0.18508300  0.54519700  0.90069400  1.0
  Si  Si18  1  0.12531500  0.28913400  0.45724400  1.0
  Si  Si19  1  0.45578700  0.00411600  0.76392300  1.0
  Si  Si20  1  0.81491700  0.45480300  0.09930600  1.0
  Si  Si21  1  0.18195600  0.89280300  0.43382000  1.0
  Si  Si22  1  0.44945800  0.59790200  0.76219100  1.0
  Si  Si23  1  0.80662300  0.03174300  0.09574600  1.0