# generated using pymatgen
data_CrCu2N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21475657
_cell_length_b   5.36755664
_cell_length_c   5.37355100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.97410306
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrCu2N3
_chemical_formula_sum   'Cr2 Cu4 N6'
_cell_volume   128.96015067
_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
  Cr  Cr0  1  0.00000000  0.84213500  0.94360400  1.0
  Cr  Cr1  1  0.00000000  0.15786500  0.44360400  1.0
  Cu  Cu2  1  0.30796100  0.82979700  0.49497700  1.0
  Cu  Cu3  1  0.69203900  0.52183700  0.49497700  1.0
  Cu  Cu4  1  0.69203900  0.17020300  0.99497700  1.0
  Cu  Cu5  1  0.30796100  0.47816300  0.99497700  1.0
  N  N6  1  0.31539500  0.82922300  0.86201900  1.0
  N  N7  1  0.68460500  0.51382700  0.86201900  1.0
  N  N8  1  0.68460500  0.17077700  0.36201900  1.0
  N  N9  1  0.31539500  0.48617300  0.36201900  1.0
  N  N10  1  0.00000000  0.85551500  0.28678600  1.0
  N  N11  1  0.00000000  0.14448500  0.78678600  1.0