# generated using pymatgen
data_Zr3AsN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85571504
_cell_length_b   5.85571533
_cell_length_c   8.55246442
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   145.25111241
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3AsN
_chemical_formula_sum   'Zr6 As2 N2'
_cell_volume   167.15193172
_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
  Zr  Zr0  1  0.63166050  0.36833950  0.94554116  1.0
  Zr  Zr1  1  0.36833950  0.63166050  0.44554116  1.0
  Zr  Zr2  1  0.36833950  0.63166050  0.05445884  1.0
  Zr  Zr3  1  0.63166050  0.36833950  0.55445884  1.0
  Zr  Zr4  1  0.94146834  0.05853166  0.75000000  1.0
  Zr  Zr5  1  0.05853166  0.94146834  0.25000000  1.0
  As  As6  1  0.25447632  0.74552368  0.75000000  1.0
  As  As7  1  0.74552368  0.25447632  0.25000000  1.0
  N  N8  1  0.00000000  0.00000000  0.00000000  1.0
  N  N9  1  0.00000000  0.00000000  0.50000000  1.0