# generated using pymatgen
data_Li12Cu11As12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.07992060
_cell_length_b   4.07992090
_cell_length_c   35.99458597
_cell_angle_alpha   89.99734299
_cell_angle_beta   89.99730750
_cell_angle_gamma   59.99605915
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li12Cu11As12
_chemical_formula_sum   'Li12 Cu11 As12'
_cell_volume   518.86457522
_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
  Li  Li0  1  0.99998932  0.99999317  0.13147098  1
  Li  Li1  1  0.00002377  0.00002121  0.38399937  1
  Li  Li2  1  0.00003343  0.00002712  0.63550915  1
  Li  Li3  1  0.99982243  0.99981869  0.88645715  1
  Li  Li4  1  0.00002230  0.00001622  0.04537093  1
  Li  Li5  1  0.00008006  0.00007224  0.29811140  1
  Li  Li6  1  0.00001849  0.00001567  0.55112292  1
  Li  Li7  1  -0.00003147  -0.00003088  0.80147342  1
  Li  Li8  1  0.00002841  0.00002528  0.21296910  1
  Li  Li9  1  0.99988498  0.99988725  0.46631507  1
  Li  Li10  1  0.99980263  0.99977480  0.71718988  1
  Li  Li11  1  0.00010669  0.00010311  0.97048480  1
  Cu  Cu12  1  0.66667447  0.66667105  0.09725824  1
  Cu  Cu13  1  0.66673722  0.66673082  0.35010359  1
  Cu  Cu14  1  0.66665556  0.66665054  0.60300498  1
  Cu  Cu15  1  0.66663706  0.66663887  0.85469980  1
  Cu  Cu16  1  0.33331818  0.33331757  0.17467579  1
  Cu  Cu17  1  0.33329806  0.33330673  0.42630588  1
  Cu  Cu18  1  0.33337453  0.33336728  0.67651298  1
  Cu  Cu19  1  0.33336063  0.33336063  0.93620907  1
  Cu  Cu20  1  0.66669231  0.66668823  0.24548417  1
  Cu  Cu21  1  0.66666394  0.66667452  0.49841598  1
  Cu  Cu22  1  0.66664056  0.66663923  0.74850750  1
  As  As23  1  0.33338484  0.33337089  0.26191635  1
  As  As24  1  0.33333808  0.33338133  0.51497925  1
  As  As25  1  0.33327648  0.33327742  0.76539653  1
  As  As26  1  0.33342134  0.33348899  0.01045742  1
  As  As27  1  0.66660877  0.66660696  0.17064705  1
  As  As28  1  0.66657212  0.66658889  0.42441360  1
  As  As29  1  0.66670371  0.66668711  0.67571847  1
  As  As30  1  0.66667253  0.66667357  0.92346645  1
  As  As31  1  0.33337203  0.33336034  0.07854645  1
  As  As32  1  0.33353911  0.33351881  0.33382956  1
  As  As33  1  0.33327341  0.33326105  0.58632900  1
  As  As34  1  0.33330502  0.33331226  0.83589671  1
