# generated using pymatgen
data_CaMg2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.75898616
_cell_length_b   6.75898616
_cell_length_c   7.92893700
_cell_angle_alpha   78.22545161
_cell_angle_beta   78.22545161
_cell_angle_gamma   29.56944783
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaMg2
_chemical_formula_sum   'Ca2 Mg4'
_cell_volume   174.72373688
_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  0.61910300  0.61910300  0.26319500  1.0
  Ca  Ca1  1  0.93847300  0.93847300  0.62140000  1.0
  Mg  Mg2  1  0.99424500  0.99424500  0.00222900  1.0
  Mg  Mg3  1  0.33584200  0.33584200  0.32121900  1.0
  Mg  Mg4  1  0.66868300  0.66868300  0.67839200  1.0
  Mg  Mg5  1  0.27698800  0.27698800  0.94689800  1.0