# generated using pymatgen
data_Mn3(FeN2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.69189898
_cell_length_b   7.14690586
_cell_length_c   10.17283269
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3(FeN2)2
_chemical_formula_sum   'Mn12 Fe8 N16'
_cell_volume   341.12112575
_cell_formula_units_Z   4
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  0.58493100  0.13984200  0.45236500  1
  Mn  Mn1  1  0.91506900  0.86015800  0.45236500  1
  Mn  Mn2  1  0.58493100  0.36015800  0.04763500  1
  Mn  Mn3  1  0.91506900  0.63984200  0.04763500  1
  Mn  Mn4  1  0.41506900  0.86015800  0.54763500  1
  Mn  Mn5  1  0.08493100  0.13984200  0.54763500  1
  Mn  Mn6  1  0.41506900  0.63984200  0.95236500  1
  Mn  Mn7  1  0.08493100  0.36015800  0.95236500  1
  Mn  Mn8  1  0.75000000  0.50000000  0.49985900  1
  Mn  Mn9  1  0.75000000  0.00000000  0.00014100  1
  Mn  Mn10  1  0.25000000  0.50000000  0.50014100  1
  Mn  Mn11  1  0.25000000  0.00000000  0.99985900  1
  Fe  Fe12  1  0.75000000  0.50000000  0.74718200  1
  Fe  Fe13  1  0.75000000  0.00000000  0.75281800  1
  Fe  Fe14  1  0.25000000  0.50000000  0.25281800  1
  Fe  Fe15  1  0.25000000  0.00000000  0.24718200  1
  Fe  Fe16  1  0.29811700  0.25000000  0.75000000  1
  Fe  Fe17  1  0.20188300  0.75000000  0.75000000  1
  Fe  Fe18  1  0.70188300  0.75000000  0.25000000  1
  Fe  Fe19  1  0.79811700  0.25000000  0.25000000  1
  N  N20  1  0.00556800  0.37960000  0.62188900  1
  N  N21  1  0.49443200  0.62040000  0.62188900  1
  N  N22  1  0.00556800  0.12040000  0.87811100  1
  N  N23  1  0.49443200  0.87960000  0.87811100  1
  N  N24  1  0.99443200  0.62040000  0.37811100  1
  N  N25  1  0.50556800  0.37960000  0.37811100  1
  N  N26  1  0.99443200  0.87960000  0.12188900  1
  N  N27  1  0.50556800  0.12040000  0.12188900  1
  N  N28  1  0.48228500  0.40465700  0.87298100  1
  N  N29  1  0.01771500  0.59534300  0.87298100  1
  N  N30  1  0.48228500  0.09534300  0.62701900  1
  N  N31  1  0.01771500  0.90465700  0.62701900  1
  N  N32  1  0.51771500  0.59534300  0.12701900  1
  N  N33  1  0.98228500  0.40465700  0.12701900  1
  N  N34  1  0.51771500  0.90465700  0.37298100  1
  N  N35  1  0.98228500  0.09534300  0.37298100  1
