# generated using pymatgen
data_Mn8Fe3N8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.37772391
_cell_length_b   4.03190788
_cell_length_c   6.39413878
_cell_angle_alpha   90.00000000
_cell_angle_beta   105.96836516
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn8Fe3N8
_chemical_formula_sum   'Mn16 Fe6 N16'
_cell_volume   356.36342331
_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  0.95570000  0.00000000  0.77772700  1
  Mn  Mn1  1  0.54430100  0.50000000  0.22227300  1
  Mn  Mn2  1  0.68114400  0.00000000  0.41784500  1
  Mn  Mn3  1  0.81885600  0.50000000  0.58215500  1
  Mn  Mn4  1  0.59829200  0.00000000  0.96503300  1
  Mn  Mn5  1  0.90170800  0.50000000  0.03496700  1
  Mn  Mn6  1  0.64060600  0.50000000  0.69075300  1
  Mn  Mn7  1  0.85939400  0.00000000  0.30924700  1
  Mn  Mn8  1  0.45570000  0.50000000  0.77772700  1
  Mn  Mn9  1  0.04430100  0.00000000  0.22227300  1
  Mn  Mn10  1  0.18114400  0.50000000  0.41784500  1
  Mn  Mn11  1  0.31885600  0.00000000  0.58215500  1
  Mn  Mn12  1  0.09829200  0.50000000  0.96503300  1
  Mn  Mn13  1  0.40170800  0.00000000  0.03496700  1
  Mn  Mn14  1  0.14060600  0.00000000  0.69075300  1
  Mn  Mn15  1  0.35939400  0.50000000  0.30924700  1
  Fe  Fe16  1  0.00000000  0.50000000  0.50000000  1
  Fe  Fe17  1  0.77301300  0.00000000  0.85507100  1
  Fe  Fe18  1  0.72698700  0.50000000  0.14492900  1
  Fe  Fe19  1  0.50000000  0.00000000  0.50000000  1
  Fe  Fe20  1  0.27301300  0.50000000  0.85507100  1
  Fe  Fe21  1  0.22698700  0.00000000  0.14492900  1
  N  N22  1  0.90493100  0.00000000  0.04244400  1
  N  N23  1  0.59506900  0.50000000  0.95755600  1
  N  N24  1  0.82016200  0.00000000  0.58531300  1
  N  N25  1  0.67983800  0.50000000  0.41468700  1
  N  N26  1  0.63735400  0.00000000  0.68675300  1
  N  N27  1  0.86264600  0.50000000  0.31324700  1
  N  N28  1  0.95641400  0.50000000  0.77019500  1
  N  N29  1  0.54358600  0.00000000  0.22980500  1
  N  N30  1  0.40493100  0.50000000  0.04244400  1
  N  N31  1  0.09506900  0.00000000  0.95755600  1
  N  N32  1  0.32016200  0.50000000  0.58531300  1
  N  N33  1  0.17983800  0.00000000  0.41468700  1
  N  N34  1  0.13735400  0.50000000  0.68675300  1
  N  N35  1  0.36264600  0.00000000  0.31324700  1
  N  N36  1  0.45641400  0.00000000  0.77019500  1
  N  N37  1  0.04358600  0.50000000  0.22980500  1
