# generated using pymatgen
data_La2Cu(NCl)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.99978203
_cell_length_b   3.99978139
_cell_length_c   8.64612620
_cell_angle_alpha   103.37391331
_cell_angle_beta   103.37390667
_cell_angle_gamma   90.00000152
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2Cu(NCl)2
_chemical_formula_sum   'La2 Cu1 N2 Cl2'
_cell_volume   130.71304256
_cell_formula_units_Z   1
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
  La  La0  1  0.40182700  0.40182700  0.80365500  1.0
  La  La1  1  0.59817300  0.59817300  0.19634500  1.0
  Cu  Cu2  1  0.00000000  0.00000000  0.00000000  1.0
  N  N3  1  0.50000000  0.00000000  0.00000000  1.0
  N  N4  1  0.00000000  0.50000000  0.00000000  1.0
  Cl  Cl5  1  0.18433600  0.18433600  0.36867100  1.0
  Cl  Cl6  1  0.81566400  0.81566400  0.63132900  1.0