# generated using pymatgen
data_Ca2Mg3Si
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.05656735
_cell_length_b   6.05656735
_cell_length_c   9.46163300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999293
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2Mg3Si
_chemical_formula_sum   'Ca4 Mg6 Si2'
_cell_volume   300.57292908
_cell_formula_units_Z   2
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
  Ca  Ca0  1  0.33333300  0.66666700  0.94111100  1.0
  Ca  Ca1  1  0.66666700  0.33333300  0.05888900  1.0
  Ca  Ca2  1  0.66666700  0.33333300  0.44111100  1.0
  Ca  Ca3  1  0.33333300  0.66666700  0.55888900  1.0
  Mg  Mg4  1  0.16507800  0.83492200  0.25000000  1.0
  Mg  Mg5  1  0.16507800  0.33015600  0.25000000  1.0
  Mg  Mg6  1  0.66984400  0.83492200  0.25000000  1.0
  Mg  Mg7  1  0.83492200  0.16507800  0.75000000  1.0
  Mg  Mg8  1  0.83492200  0.66984400  0.75000000  1.0
  Mg  Mg9  1  0.33015600  0.16507800  0.75000000  1.0
  Si  Si10  1  0.00000000  0.00000000  0.50000000  1.0
  Si  Si11  1  0.00000000  0.00000000  0.00000000  1.0