# generated using pymatgen
data_CaMgIn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.00599005
_cell_length_b   13.82483352
_cell_length_c   13.82483392
_cell_angle_alpha   61.05430169
_cell_angle_beta   64.26443805
_cell_angle_gamma   64.26443719
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaMgIn2
_chemical_formula_sum   'Ca1 Mg1 In2'
_cell_volume   1734.21524166
_cell_formula_units_Z   1
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  0.50000000  -0.00000000  0.00000000  1.0
  Mg  Mg1  1  -0.00000000  -0.00000000  0.00000000  1.0
  In  In2  1  0.76500822  1.00000000  1.00000000  1.0
  In  In3  1  0.23499178  0.00000000  0.00000000  1.0