# generated using pymatgen
data_CaMg14Zr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.50475548
_cell_length_b   6.57983543
_cell_length_c   10.32971809
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.38256253
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaMg14Zr
_chemical_formula_sum   'Ca1 Mg14 Zr1'
_cell_volume   381.39762326
_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  0.16778174  0.33389037  0.12500000  1.0
  Mg  Mg1  1  0.16647852  0.33323876  0.62500000  1.0
  Mg  Mg2  1  0.16561749  0.83280824  0.62500000  1.0
  Mg  Mg3  1  0.66523320  0.33492945  0.12500000  1.0
  Mg  Mg4  1  0.66756466  0.33513740  0.62500000  1.0
  Mg  Mg5  1  0.66523320  0.83030274  0.12500000  1.0
  Mg  Mg6  1  0.66756466  0.83242626  0.62500000  1.0
  Mg  Mg7  1  0.33237223  0.15880211  0.37953681  1.0
  Mg  Mg8  1  0.33237223  0.15880211  0.87046319  1.0
  Mg  Mg9  1  0.33237223  0.67357112  0.37953681  1.0
  Mg  Mg10  1  0.33237223  0.67357112  0.87046319  1.0
  Mg  Mg11  1  0.82376323  0.16188212  0.38054755  1.0
  Mg  Mg12  1  0.82376323  0.16188212  0.86945245  1.0
  Mg  Mg13  1  0.83681477  0.66840788  0.37117384  1.0
  Mg  Mg14  1  0.83681477  0.66840788  0.87882616  1.0
  Zr  Zr15  1  0.18388164  0.84194032  0.12500000  1.0