# generated using pymatgen
data_Cr3N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.18114098
_cell_length_b   8.18114098
_cell_length_c   8.18114098
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr3N4
_chemical_formula_sum   'Cr24 N32'
_cell_volume   547.57250108
_cell_formula_units_Z   8
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  0.00000000  0.50000000  1
  Cr  Cr1  1  0.25000000  0.75000000  0.25000000  1
  Cr  Cr2  1  0.87500000  0.62500000  0.37500000  1
  Cr  Cr3  1  0.12500000  0.87500000  0.87500000  1
  Cr  Cr4  1  0.12500000  0.62500000  0.62500000  1
  Cr  Cr5  1  0.87500000  0.87500000  0.12500000  1
  Cr  Cr6  1  0.00000000  0.50000000  0.00000000  1
  Cr  Cr7  1  0.25000000  0.25000000  0.75000000  1
  Cr  Cr8  1  0.87500000  0.12500000  0.87500000  1
  Cr  Cr9  1  0.12500000  0.37500000  0.37500000  1
  Cr  Cr10  1  0.12500000  0.12500000  0.12500000  1
  Cr  Cr11  1  0.87500000  0.37500000  0.62500000  1
  Cr  Cr12  1  0.50000000  0.00000000  0.00000000  1
  Cr  Cr13  1  0.75000000  0.75000000  0.75000000  1
  Cr  Cr14  1  0.37500000  0.62500000  0.87500000  1
  Cr  Cr15  1  0.62500000  0.87500000  0.37500000  1
  Cr  Cr16  1  0.62500000  0.62500000  0.12500000  1
  Cr  Cr17  1  0.37500000  0.87500000  0.62500000  1
  Cr  Cr18  1  0.50000000  0.50000000  0.50000000  1
  Cr  Cr19  1  0.75000000  0.25000000  0.25000000  1
  Cr  Cr20  1  0.37500000  0.12500000  0.37500000  1
  Cr  Cr21  1  0.62500000  0.37500000  0.87500000  1
  Cr  Cr22  1  0.62500000  0.12500000  0.62500000  1
  Cr  Cr23  1  0.37500000  0.37500000  0.12500000  1
  N  N24  1  0.12868600  0.87131400  0.62868600  1
  N  N25  1  0.37131400  0.62868600  0.62868600  1
  N  N26  1  0.37131400  0.87131400  0.87131400  1
  N  N27  1  0.12868600  0.12868600  0.37131400  1
  N  N28  1  0.12131400  0.87868600  0.12131400  1
  N  N29  1  0.87868600  0.12131400  0.12131400  1
  N  N30  1  0.87868600  0.87868600  0.87868600  1
  N  N31  1  0.12131400  0.62131400  0.37868600  1
  N  N32  1  0.12868600  0.37131400  0.12868600  1
  N  N33  1  0.37131400  0.12868600  0.12868600  1
  N  N34  1  0.37131400  0.37131400  0.37131400  1
  N  N35  1  0.12868600  0.62868600  0.87131400  1
  N  N36  1  0.12131400  0.37868600  0.62131400  1
  N  N37  1  0.87868600  0.62131400  0.62131400  1
  N  N38  1  0.87868600  0.37868600  0.37868600  1
  N  N39  1  0.12131400  0.12131400  0.87868600  1
  N  N40  1  0.62868600  0.87131400  0.12868600  1
  N  N41  1  0.87131400  0.62868600  0.12868600  1
  N  N42  1  0.87131400  0.87131400  0.37131400  1
  N  N43  1  0.62868600  0.12868600  0.87131400  1
  N  N44  1  0.62131400  0.87868600  0.62131400  1
  N  N45  1  0.37868600  0.12131400  0.62131400  1
  N  N46  1  0.37868600  0.87868600  0.37868600  1
  N  N47  1  0.62131400  0.62131400  0.87868600  1
  N  N48  1  0.62868600  0.37131400  0.62868600  1
  N  N49  1  0.87131400  0.12868600  0.62868600  1
  N  N50  1  0.87131400  0.37131400  0.87131400  1
  N  N51  1  0.62868600  0.62868600  0.37131400  1
  N  N52  1  0.62131400  0.37868600  0.12131400  1
  N  N53  1  0.37868600  0.62131400  0.12131400  1
  N  N54  1  0.37868600  0.37868600  0.87868600  1
  N  N55  1  0.62131400  0.12131400  0.37868600  1
