# generated using pymatgen
data_MgSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.30988700
_cell_length_b   5.43870000
_cell_length_c   9.50517173
_cell_angle_alpha   89.25443600
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSi
_chemical_formula_sum   'Mg6 Si6'
_cell_volume   222.78409633
_cell_formula_units_Z   6
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  0.25000000  0.65759300  0.56826900  1.0
  Mg  Mg1  1  0.25000000  0.89405800  0.87940600  1.0
  Mg  Mg2  1  0.75000000  0.10594200  0.12059400  1.0
  Mg  Mg3  1  0.25000000  0.58951500  0.23683100  1.0
  Mg  Mg4  1  0.75000000  0.41048500  0.76316900  1.0
  Mg  Mg5  1  0.75000000  0.34240700  0.43173100  1.0
  Si  Si6  1  0.75000000  0.83862700  0.40292900  1.0
  Si  Si7  1  0.25000000  0.38912000  0.95838900  1.0
  Si  Si8  1  0.25000000  0.16137300  0.59707100  1.0
  Si  Si9  1  0.75000000  0.92583500  0.66362200  1.0
  Si  Si10  1  0.25000000  0.07416500  0.33637800  1.0
  Si  Si11  1  0.75000000  0.61088000  0.04161100  1.0