# generated using pymatgen
data_Cu3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.86159702
_cell_length_b   5.86159702
_cell_length_c   5.86159702
_cell_angle_alpha   151.92358550
_cell_angle_beta   151.92358550
_cell_angle_gamma   40.12490349
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu3N
_chemical_formula_sum   'Cu3 N1'
_cell_volume   44.52369971
_cell_formula_units_Z   1
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
  Cu  Cu0  1  0.00000000  0.00000000  0.00000000  1.0
  Cu  Cu1  1  0.32183300  0.32183300  0.00000000  1.0
  Cu  Cu2  1  0.67816700  0.67816700  0.00000000  1.0
  N  N3  1  0.50000000  0.50000000  0.00000000  1.0