# generated using pymatgen
data_MgSi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.54246900
_cell_length_b   6.85855601
_cell_length_c   10.66464715
_cell_angle_alpha   94.14718566
_cell_angle_beta   89.49520982
_cell_angle_gamma   100.15075938
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSi2
_chemical_formula_sum   'Mg8 Si16'
_cell_volume   469.81525492
_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  0.25842500  0.16025800  0.26172900  1.0
  Mg  Mg1  1  0.74157500  0.83974200  0.73827100  1.0
  Mg  Mg2  1  0.78042400  0.59656800  0.98433100  1.0
  Mg  Mg3  1  0.59016600  0.35019000  0.73700400  1.0
  Mg  Mg4  1  0.79338600  0.01794700  0.14419000  1.0
  Mg  Mg5  1  0.20661400  0.98205300  0.85581000  1.0
  Mg  Mg6  1  0.40983400  0.64981000  0.26299600  1.0
  Mg  Mg7  1  0.21957600  0.40343200  0.01566900  1.0
  Si  Si8  1  0.45809100  0.32598400  0.47108400  1.0
  Si  Si9  1  0.88382100  0.18664100  0.87696700  1.0
  Si  Si10  1  0.44607700  0.81911600  0.01927900  1.0
  Si  Si11  1  0.27169500  0.11865800  0.61950000  1.0
  Si  Si12  1  0.61804300  0.37024700  0.17360800  1.0
  Si  Si13  1  0.21949600  0.78610500  0.53275900  1.0
  Si  Si14  1  0.72830500  0.88134200  0.38050000  1.0
  Si  Si15  1  0.97696200  0.26779300  0.65961400  1.0
  Si  Si16  1  0.11617900  0.81335900  0.12303300  1.0
  Si  Si17  1  0.78050400  0.21389500  0.46724100  1.0
  Si  Si18  1  0.02303800  0.73220700  0.34038600  1.0
  Si  Si19  1  0.38195700  0.62975300  0.82639200  1.0
  Si  Si20  1  0.94043600  0.38257400  0.29164000  1.0
  Si  Si21  1  0.55392300  0.18088400  0.98072100  1.0
  Si  Si22  1  0.05956400  0.61742600  0.70836000  1.0
  Si  Si23  1  0.54190900  0.67401600  0.52891600  1.0