# generated using pymatgen
data_Co5CuN4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.50274000
_cell_length_b   5.61349100
_cell_length_c   4.16662500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co5CuN4
_chemical_formula_sum   'Co10 Cu2 N8'
_cell_volume   198.87323819
_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
  Co  Co0  1  0.58485100  0.47849800  0.26776000  1.0
  Co  Co1  1  0.91514900  0.47849800  0.26776000  1.0
  Co  Co2  1  0.58485200  0.02150000  0.26775900  1.0
  Co  Co3  1  0.91514800  0.02150000  0.26775900  1.0
  Co  Co4  1  0.41514900  0.52150200  0.73224000  1.0
  Co  Co5  1  0.08485100  0.52150200  0.73224000  1.0
  Co  Co6  1  0.41514800  0.97850000  0.73224100  1.0
  Co  Co7  1  0.08485200  0.97850000  0.73224100  1.0
  Co  Co8  1  0.75000000  0.75000000  0.70881400  1.0
  Co  Co9  1  0.25000000  0.25000000  0.29118600  1.0
  Cu  Cu10  1  0.75000000  0.24999800  0.71906000  1.0
  Cu  Cu11  1  0.25000000  0.75000200  0.28094000  1.0
  N  N12  1  0.75000000  0.98403600  0.00875800  1.0
  N  N13  1  0.75000000  0.51596000  0.00875700  1.0
  N  N14  1  0.25000000  0.01596400  0.99124200  1.0
  N  N15  1  0.25000000  0.48404000  0.99124300  1.0
  N  N16  1  0.54736300  0.74999800  0.51433100  1.0
  N  N17  1  0.95263700  0.74999800  0.51433100  1.0
  N  N18  1  0.45263700  0.25000200  0.48566900  1.0
  N  N19  1  0.04736300  0.25000200  0.48566900  1.0