# generated using pymatgen
data_LiCo2(PIr)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.71861855
_cell_length_b   10.39234076
_cell_length_c   12.06413358
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCo2(PIr)3
_chemical_formula_sum   'Li4 Co8 P12 Ir12'
_cell_volume   466.22026500
_cell_formula_units_Z   4
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  0.25000000  0.91603137  0.20997103  1.0
  Li  Li1  1  0.75000000  0.08396863  0.79002897  1.0
  Li  Li2  1  0.75000000  0.41603137  0.29002897  1.0
  Li  Li3  1  0.25000000  0.58396863  0.70997103  1.0
  Co  Co4  1  0.25000000  0.61944495  0.19574354  1.0
  Co  Co5  1  0.75000000  0.38055505  0.80425646  1.0
  Co  Co6  1  0.75000000  0.11944495  0.30425646  1.0
  Co  Co7  1  0.25000000  0.88055505  0.69574354  1.0
  Co  Co8  1  0.25000000  0.04111772  0.43538276  1.0
  Co  Co9  1  0.75000000  0.95888228  0.56461724  1.0
  Co  Co10  1  0.75000000  0.54111772  0.06461724  1.0
  Co  Co11  1  0.25000000  0.45888228  0.93538276  1.0
  P  P12  1  0.25000000  0.06678264  0.61596377  1.0
  P  P13  1  0.75000000  0.93321736  0.38403623  1.0
  P  P14  1  0.75000000  0.56678264  0.88403623  1.0
  P  P15  1  0.25000000  0.43321736  0.11596377  1.0
  P  P16  1  0.25000000  0.23354498  0.36838837  1.0
  P  P17  1  0.75000000  0.76645502  0.63161163  1.0
  P  P18  1  0.75000000  0.73354498  0.13161163  1.0
  P  P19  1  0.25000000  0.26645502  0.86838837  1.0
  P  P20  1  0.25000000  0.90378482  0.87616870  1.0
  P  P21  1  0.75000000  0.09621518  0.12383130  1.0
  P  P22  1  0.75000000  0.40378482  0.62383130  1.0
  P  P23  1  0.25000000  0.59621518  0.37616870  1.0
  Ir  Ir24  1  0.25000000  0.78514765  0.48819234  1.0
  Ir  Ir25  1  0.75000000  0.21485235  0.51180766  1.0
  Ir  Ir26  1  0.75000000  0.28514765  0.01180766  1.0
  Ir  Ir27  1  0.25000000  0.71485235  0.98819234  1.0
  Ir  Ir28  1  0.25000000  0.08989004  0.97762134  1.0
  Ir  Ir29  1  0.75000000  0.91010996  0.02237866  1.0
  Ir  Ir30  1  0.75000000  0.58989004  0.52237866  1.0
  Ir  Ir31  1  0.25000000  0.41010996  0.47762134  1.0
  Ir  Ir32  1  0.25000000  0.27177518  0.68099966  1.0
  Ir  Ir33  1  0.75000000  0.72822482  0.31900034  1.0
  Ir  Ir34  1  0.75000000  0.77177518  0.81900034  1.0
  Ir  Ir35  1  0.25000000  0.22822482  0.18099966  1.0