# generated using pymatgen
data_Cr3N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.78493957
_cell_length_b   5.78493957
_cell_length_c   5.78493957
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr3N4
_chemical_formula_sum   'Cr6 N8'
_cell_volume   136.89307608
_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  0.50000000  0.50000000  0.50000000  1.0
  Cr  Cr1  1  0.75000000  0.75000000  0.75000000  1.0
  Cr  Cr2  1  0.12500000  0.62500000  0.12500000  1.0
  Cr  Cr3  1  0.62500000  0.12500000  0.12500000  1.0
  Cr  Cr4  1  0.12500000  0.12500000  0.12500000  1.0
  Cr  Cr5  1  0.12500000  0.12500000  0.62500000  1.0
  N  N6  1  0.37131400  0.88605800  0.37131400  1.0
  N  N7  1  0.88605800  0.37131400  0.37131400  1.0
  N  N8  1  0.37131400  0.37131400  0.37131400  1.0
  N  N9  1  0.37131400  0.37131400  0.88605800  1.0
  N  N10  1  0.87868600  0.36394200  0.87868600  1.0
  N  N11  1  0.36394200  0.87868600  0.87868600  1.0
  N  N12  1  0.87868600  0.87868600  0.87868600  1.0
  N  N13  1  0.87868600  0.87868600  0.36394200  1.0