# generated using pymatgen
data_NdHoCI
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.81701298
_cell_length_b   3.81701340
_cell_length_c   15.07106508
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998766
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdHoCI
_chemical_formula_sum   'Nd2 Ho2 C2 I2'
_cell_volume   190.16121841
_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
  Nd  Nd0  1  0.33333300  0.66666700  0.41322317  1.0
  Nd  Nd1  1  0.66666700  0.33333300  0.91322317  1.0
  Ho  Ho2  1  0.66666700  0.33333300  0.58476880  1.0
  Ho  Ho3  1  0.33333300  0.66666700  0.08476880  1.0
  C  C4  1  0.00000000  0.00000000  0.50883685  1.0
  C  C5  1  0.00000000  0.00000000  0.00883685  1.0
  I  I6  1  0.66666700  0.33333300  0.24317018  1.0
  I  I7  1  0.33333300  0.66666700  0.74317018  1.0