# generated using pymatgen
data_Mg14GaB
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.17570868
_cell_length_b   6.70856781
_cell_length_c   9.63838242
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   122.89775945
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg14GaB
_chemical_formula_sum   'Mg14 Ga1 B1'
_cell_volume   335.28525961
_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
  Mg  Mg0  1  0.17956025  0.33977963  0.62500000  1.0
  Mg  Mg1  1  0.19753318  0.84876608  0.62500000  1.0
  Mg  Mg2  1  0.75815263  0.37382956  0.12500000  1.0
  Mg  Mg3  1  0.67441478  0.34283820  0.62500000  1.0
  Mg  Mg4  1  0.75815263  0.88432208  0.12500000  1.0
  Mg  Mg5  1  0.67441478  0.83157557  0.62500000  1.0
  Mg  Mg6  1  0.30030005  0.17657373  0.32776696  1.0
  Mg  Mg7  1  0.30030005  0.17657373  0.92223304  1.0
  Mg  Mg8  1  0.30030005  0.62372732  0.32776696  1.0
  Mg  Mg9  1  0.30030005  0.62372732  0.92223304  1.0
  Mg  Mg10  1  0.79363905  0.14682002  0.37485691  1.0
  Mg  Mg11  1  0.79363905  0.14682002  0.87514309  1.0
  Mg  Mg12  1  0.82859467  0.66429784  0.37539876  1.0
  Mg  Mg13  1  0.82859467  0.66429784  0.87460124  1.0
  Ga  Ga14  1  0.19868891  0.84934396  0.12500000  1.0
  B  B15  1  0.11341520  0.30670710  0.12500000  1.0