# generated using pymatgen
data_Ca3MgNi14
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.29714602
_cell_length_b   12.29714602
_cell_length_c   12.29714626
_cell_angle_alpha   23.40280199
_cell_angle_beta   23.40280199
_cell_angle_gamma   23.40279796
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3MgNi14
_chemical_formula_sum   'Ca3 Mg1 Ni14'
_cell_volume   257.59625419
_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  0.05178700  0.05178700  0.05178700  1.0
  Ca  Ca1  1  0.94736700  0.94736700  0.94736700  1.0
  Ca  Ca2  1  0.14969500  0.14969500  0.14969500  1.0
  Mg  Mg3  1  0.85154500  0.85154500  0.85154500  1.0
  Ni  Ni4  1  0.27784000  0.27784000  0.27784000  1.0
  Ni  Ni5  1  0.72204000  0.72204000  0.72204000  1.0
  Ni  Ni6  1  0.38857100  0.38857100  0.38857100  1.0
  Ni  Ni7  1  0.61179100  0.61179100  0.61179100  1.0
  Ni  Ni8  1  0.10831100  0.61115000  0.61115000  1.0
  Ni  Ni9  1  0.61115000  0.61115000  0.10831100  1.0
  Ni  Ni10  1  0.61115000  0.10831100  0.61115000  1.0
  Ni  Ni11  1  0.89049000  0.38903000  0.38903000  1.0
  Ni  Ni12  1  0.38903000  0.38903000  0.89049000  1.0
  Ni  Ni13  1  0.38903000  0.89049000  0.38903000  1.0
  Ni  Ni14  1  0.49966000  0.49966000  0.00054000  1.0
  Ni  Ni15  1  0.49966000  0.00054000  0.49966000  1.0
  Ni  Ni16  1  0.00054000  0.49966000  0.49966000  1.0
  Ni  Ni17  1  0.50034400  0.50034400  0.50034400  1.0