data_SrMg14Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.41
_cell_length_b   6.6
_cell_length_c   6.6
_cell_angle_alpha   55.78
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrMg14Fe
_chemical_formula_sum   'Sr1 Mg14 Fe1'
_cell_volume   374.78
_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
  Sr  Sr0  1  0.2  0.0  0.94  1.0
  Mg  Mg1  1  0.0  0.0  0.01  1.0
  Mg  Mg2  1  0.0  0.0  0.78  1.0
  Mg  Mg3  1  0.2  0.41  0.02  1.0
  Mg  Mg4  1  0.0  0.48  0.9  1.0
  Mg  Mg5  1  0.2  0.59  0.02  1.0
  Mg  Mg6  1  0.0  0.52  0.9  1.0
  Mg  Mg7  1  0.57  0.41  0.75  1.0
  Mg  Mg8  1  0.84  0.41  0.75  1.0
  Mg  Mg9  1  0.57  0.59  0.75  1.0
  Mg  Mg10  1  0.84  0.59  0.75  1.0
  Mg  Mg11  1  0.82  0.0  0.74  1.0
  Mg  Mg12  1  0.59  0.0  0.74  1.0
  Mg  Mg13  1  0.44  0.0  0.74  1.0
  Mg  Mg14  1  0.97  0.0  0.74  1.0
  Fe  Fe15  1  0.2  0.0  0.79  1.0

data_SrMg14Fe
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.17
_cell_length_b   6.6
_cell_length_c   10.41
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   117.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrMg14Fe
_chemical_formula_sum   'Sr1 Mg14 Fe1'
_cell_volume   374.78
_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
  Sr  Sr0  1  0.94  0.94  0.8  1.0
  Mg  Mg1  1  0.01  0.01  0.0  1.0
  Mg  Mg2  1  0.02  0.61  0.8  1.0
  Mg  Mg3  1  0.02  0.44  0.8  1.0
  Mg  Mg4  1  0.74  0.74  0.03  1.0
  Mg  Mg5  1  0.74  0.74  0.56  1.0
  Mg  Mg6  1  0.74  0.74  0.18  1.0
  Mg  Mg7  1  0.74  0.74  0.41  1.0
  Mg  Mg8  1  0.75  0.16  0.16  1.0
  Mg  Mg9  1  0.75  0.16  0.43  1.0
  Mg  Mg10  1  0.75  0.34  0.16  1.0
  Mg  Mg11  1  0.75  0.34  0.43  1.0
  Mg  Mg12  1  0.78  0.78  0.0  1.0
  Mg  Mg13  1  0.9  0.38  0.0  1.0
  Mg  Mg14  1  0.9  0.42  -0.0  1.0
  Fe  Fe15  1  0.79  0.79  0.8  1.0

Sr Mg Mg Mg Mg Mg Mg Mg Mg Mg Mg Mg Mg Mg Mg Fe