# generated using pymatgen
data_MnCo5N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.91351980
_cell_length_b   6.83147572
_cell_length_c   4.52749076
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCo5N4
_chemical_formula_sum   'Mn2 Co10 N8'
_cell_volume   182.90187476
_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  0.31753100  0.00000000  0.50000000  1
  Mn  Mn1  1  0.68246900  0.50000000  0.00000000  1
  Co  Co2  1  0.74662700  0.27668400  0.31450800  1
  Co  Co3  1  0.74662700  0.27668400  0.68549200  1
  Co  Co4  1  0.74662700  0.72331600  0.31450800  1
  Co  Co5  1  0.74662700  0.72331600  0.68549200  1
  Co  Co6  1  0.25337300  0.22331600  0.18549200  1
  Co  Co7  1  0.25337300  0.22331600  0.81450800  1
  Co  Co8  1  0.25337300  0.77668400  0.18549200  1
  Co  Co9  1  0.25337300  0.77668400  0.81450800  1
  Co  Co10  1  0.24008100  0.50000000  0.50000000  1
  Co  Co11  1  0.75991900  0.00000000  0.00000000  1
  N  N12  1  0.03179400  0.77727200  0.50000000  1
  N  N13  1  0.03179400  0.22272800  0.50000000  1
  N  N14  1  0.96820600  0.72272800  0.00000000  1
  N  N15  1  0.96820600  0.27727200  0.00000000  1
  N  N16  1  0.45483200  0.50000000  0.23456200  1
  N  N17  1  0.45483200  0.50000000  0.76543800  1
  N  N18  1  0.54516800  0.00000000  0.26543800  1
  N  N19  1  0.54516800  0.00000000  0.73456200  1
