# generated using pymatgen
data_MgSi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.22338500
_cell_length_b   6.86236991
_cell_length_c   10.26336528
_cell_angle_alpha   90.26324443
_cell_angle_beta   91.51756555
_cell_angle_gamma   90.75317595
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSi2
_chemical_formula_sum   'Mg8 Si16'
_cell_volume   438.12233211
_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  0.68132400  0.89102000  0.13039500  1.0
  Mg  Mg1  1  0.43402500  0.13088400  0.62585400  1.0
  Mg  Mg2  1  0.72538600  0.45363300  0.35329900  1.0
  Mg  Mg3  1  0.11260100  0.32748400  0.89788800  1.0
  Mg  Mg4  1  0.26654200  0.52930800  0.40667700  1.0
  Mg  Mg5  1  0.62834100  0.44479100  0.86349400  1.0
  Mg  Mg6  1  0.18467600  0.97644900  0.11602700  1.0
  Mg  Mg7  1  0.94257300  0.24270000  0.60882800  1.0
  Si  Si8  1  0.90539700  0.27357600  0.13491100  1.0
  Si  Si9  1  0.62134100  0.51175400  0.60498600  1.0
  Si  Si10  1  0.94415600  0.81944600  0.35734500  1.0
  Si  Si11  1  0.29964500  0.73116200  0.88356700  1.0
  Si  Si12  1  0.03874600  0.16148500  0.34755600  1.0
  Si  Si13  1  0.43933400  0.07151900  0.90495000  1.0
  Si  Si14  1  0.01869900  0.60982300  0.16696200  1.0
  Si  Si15  1  0.76182000  0.83869500  0.63714100  1.0
  Si  Si16  1  0.56059000  0.84106600  0.41631900  1.0
  Si  Si17  1  0.92790800  0.72346500  0.93504800  1.0
  Si  Si18  1  0.52042500  0.27136200  0.11124500  1.0
  Si  Si19  1  0.25690100  0.53340400  0.67766100  1.0
  Si  Si20  1  0.39078400  0.60025900  0.10916900  1.0
  Si  Si21  1  0.13287300  0.83782600  0.57581700  1.0
  Si  Si22  1  0.42570200  0.15344100  0.32801900  1.0
  Si  Si23  1  0.79984200  0.02528800  0.83759200  1.0