# generated using pymatgen
data_MnFeP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.11614946
_cell_length_b   5.79177731
_cell_length_c   5.14745188
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnFeP2
_chemical_formula_sum   'Mn2 Fe2 P4'
_cell_volume   92.90143666
_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
  Mn  Mn0  1  0.00000000  0.50086800  0.45224700  1
  Mn  Mn1  1  0.00000000  0.00086800  0.54775300  1
  Fe  Fe2  1  0.50000000  0.49797300  0.05280100  1
  Fe  Fe3  1  0.50000000  0.99797300  0.94719900  1
  P  P4  1  0.50000000  0.31335000  0.68601700  1
  P  P5  1  0.50000000  0.81335000  0.31398300  1
  P  P6  1  0.00000000  0.68780900  0.82267900  1
  P  P7  1  0.00000000  0.18780900  0.17732100  1
