# generated using pymatgen
data_MnNi5N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.81423378
_cell_length_b   8.51230233
_cell_length_c   4.20776582
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnNi5N4
_chemical_formula_sum   'Mn2 Ni10 N8'
_cell_volume   208.25291613
_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  0.26198100  0.00000000  0.50000000  1
  Mn  Mn1  1  0.73801900  0.50000000  0.00000000  1
  Ni  Ni2  1  0.70286500  0.28657800  0.34228000  1
  Ni  Ni3  1  0.70286500  0.28657800  0.65772000  1
  Ni  Ni4  1  0.70286500  0.71342200  0.34228000  1
  Ni  Ni5  1  0.70286500  0.71342200  0.65772000  1
  Ni  Ni6  1  0.29713500  0.21342200  0.15772000  1
  Ni  Ni7  1  0.29713500  0.21342200  0.84228000  1
  Ni  Ni8  1  0.29713500  0.78657800  0.15772000  1
  Ni  Ni9  1  0.29713500  0.78657800  0.84228000  1
  Ni  Ni10  1  0.18119100  0.50000000  0.50000000  1
  Ni  Ni11  1  0.81880900  0.00000000  0.00000000  1
  N  N12  1  0.98270900  0.77584700  0.50000000  1
  N  N13  1  0.98270900  0.22415300  0.50000000  1
  N  N14  1  0.01729100  0.72415300  0.00000000  1
  N  N15  1  0.01729100  0.27584700  0.00000000  1
  N  N16  1  0.52476600  0.50000000  0.18980800  1
  N  N17  1  0.52476600  0.50000000  0.81019200  1
  N  N18  1  0.47523400  0.00000000  0.31019200  1
  N  N19  1  0.47523400  0.00000000  0.68980800  1
