# generated using pymatgen
data_MgSi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.67500300
_cell_length_b   7.70794827
_cell_length_c   9.99012891
_cell_angle_alpha   94.61400899
_cell_angle_beta   98.51304162
_cell_angle_gamma   102.72171593
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSi2
_chemical_formula_sum   'Mg8 Si16'
_cell_volume   418.66603539
_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  0.79267200  0.42461200  0.86077700  1.0
  Mg  Mg1  1  0.20732800  0.57538800  0.13922300  1.0
  Mg  Mg2  1  0.22177300  0.93227300  0.49074200  1.0
  Mg  Mg3  1  0.40901300  0.26329800  0.32714100  1.0
  Mg  Mg4  1  0.23585700  0.36277500  0.63301200  1.0
  Mg  Mg5  1  0.76414300  0.63722500  0.36698800  1.0
  Mg  Mg6  1  0.59098700  0.73670200  0.67285900  1.0
  Mg  Mg7  1  0.77822700  0.06772700  0.50925800  1.0
  Si  Si8  1  0.66059700  0.97058000  0.93801700  1.0
  Si  Si9  1  0.95458800  0.33439600  0.33946200  1.0
  Si  Si10  1  0.28931700  0.59969700  0.41840100  1.0
  Si  Si11  1  0.64706200  0.37650900  0.11645400  1.0
  Si  Si12  1  0.54289400  0.08564600  0.72818300  1.0
  Si  Si13  1  0.74005200  0.69773100  0.06547200  1.0
  Si  Si14  1  0.35293800  0.62349100  0.88354600  1.0
  Si  Si15  1  0.97464200  0.19331600  0.09430800  1.0
  Si  Si16  1  0.04541200  0.66560400  0.66053800  1.0
  Si  Si17  1  0.25994800  0.30226900  0.93452800  1.0
  Si  Si18  1  0.02535800  0.80668400  0.90569200  1.0
  Si  Si19  1  0.45710600  0.91435400  0.27181700  1.0
  Si  Si20  1  0.11427500  0.05170100  0.74739600  1.0
  Si  Si21  1  0.71068300  0.40030300  0.58159900  1.0
  Si  Si22  1  0.88572500  0.94829900  0.25260400  1.0
  Si  Si23  1  0.33940300  0.02942000  0.06198300  1.0