# generated using pymatgen
data_Sr3FeN3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.62679874
_cell_length_b   7.62629286
_cell_length_c   5.28097266
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99766804
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr3FeN3
_chemical_formula_sum   'Sr6 Fe2 N6'
_cell_volume   266.01769158
_cell_formula_units_Z   2
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  0.72540361  0.08525390  0.25000000  1.0
  Sr  Sr1  1  0.64026548  0.72548835  0.75000000  1.0
  Sr  Sr2  1  0.08529095  0.35977964  0.75000000  1.0
  Sr  Sr3  1  0.91468233  0.64014838  0.25000000  1.0
  Sr  Sr4  1  0.35981899  0.27459315  0.25000000  1.0
  Sr  Sr5  1  0.27451454  0.91472671  0.75000000  1.0
  Fe  Fe6  1  0.33332908  0.66672492  0.25000000  1.0
  Fe  Fe7  1  0.66668426  0.33328434  0.75000000  1.0
  N  N8  1  0.68807358  0.11706185  0.75000000  1.0
  N  N9  1  0.57100690  0.68824447  0.25000000  1.0
  N  N10  1  0.11714904  0.42895391  0.25000000  1.0
  N  N11  1  0.88292865  0.57091234  0.75000000  1.0
  N  N12  1  0.42910624  0.31197690  0.75000000  1.0
  N  N13  1  0.31174633  0.88285116  0.25000000  1.0