# generated using pymatgen
data_CuCSN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.83999456
_cell_length_b   3.83999456
_cell_length_c   10.95317200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000963
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuCSN
_chemical_formula_sum   'Cu2 C2 S2 N2'
_cell_volume   139.87229962
_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  0.66666700  0.33333300  0.50026900  1.0
  Cu  Cu1  1  0.33333300  0.66666700  0.00026900  1.0
  C  C2  1  0.33333300  0.66666700  0.28048800  1.0
  C  C3  1  0.66666700  0.33333300  0.78048800  1.0
  S  S4  1  0.66666700  0.33333300  0.93230500  1.0
  S  S5  1  0.33333300  0.66666700  0.43230500  1.0
  N  N6  1  0.66666700  0.33333300  0.67313800  1.0
  N  N7  1  0.33333300  0.66666700  0.17313800  1.0