# generated using pymatgen
data_CuN4O3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.78480600
_cell_length_b   8.25170548
_cell_length_c   8.25170548
_cell_angle_alpha   120.00001188
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuN4O3
_chemical_formula_sum   'Cu2 N8 O6'
_cell_volume   223.18327231
_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
  Cu  Cu0  1  0.75000000  0.00000000  0.00000000  1.0
  Cu  Cu1  1  0.25000000  0.00000000  0.00000000  1.0
  N  N2  1  0.75000000  0.76895200  0.00645800  1.0
  N  N3  1  0.75000000  0.23750600  0.23104800  1.0
  N  N4  1  0.25000000  0.76249400  0.99354200  1.0
  N  N5  1  0.75000000  0.99354200  0.76249400  1.0
  N  N6  1  0.25000000  0.00645800  0.76895200  1.0
  N  N7  1  0.25000000  0.23104800  0.23750600  1.0
  N  N8  1  0.75000000  0.66666700  0.33333300  1.0
  N  N9  1  0.25000000  0.33333300  0.66666700  1.0
  O  O10  1  0.75000000  0.84314100  0.41932400  1.0
  O  O11  1  0.75000000  0.57618300  0.15685900  1.0
  O  O12  1  0.25000000  0.42381700  0.58067600  1.0
  O  O13  1  0.75000000  0.58067600  0.42381700  1.0
  O  O14  1  0.25000000  0.41932400  0.84314100  1.0
  O  O15  1  0.25000000  0.15685900  0.57618300  1.0