# generated using pymatgen
data_CeF3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.10749571
_cell_length_b   7.11025670
_cell_length_c   7.22845846
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.95460498
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CeF3
_chemical_formula_sum   'Ce6 F18'
_cell_volume   316.50216562
_cell_formula_units_Z   6
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
  Ce  Ce0  1  0.66645164  0.00011192  0.75000000  1.0
  Ce  Ce1  1  0.33354836  -0.00011192  0.25000000  1.0
  Ce  Ce2  1  0.99814485  0.66600749  0.75000000  1.0
  Ce  Ce3  1  0.66779360  0.66793591  0.25000000  1.0
  Ce  Ce4  1  0.00185515  0.33399251  0.25000000  1.0
  Ce  Ce5  1  0.33220640  0.33206409  0.75000000  1.0
  F  F6  1  0.33334654  0.00117830  0.57914317  1.0
  F  F7  1  0.66665346  -0.00117830  0.07914317  1.0
  F  F8  1  0.66665346  -0.00117830  0.42085683  1.0
  F  F9  1  0.00100941  0.00053843  0.25000000  1.0
  F  F10  1  0.33261418  0.33381614  0.42091811  1.0
  F  F11  1  0.00158490  0.66777384  0.07915862  1.0
  F  F12  1  0.66735649  0.33371401  0.25000000  1.0
  F  F13  1  0.66738582  0.66618386  0.57908189  1.0
  F  F14  1  0.66588727  0.33296605  0.75000000  1.0
  F  F15  1  -0.00158490  0.33222616  0.92084138  1.0
  F  F16  1  0.66738582  0.66618386  0.92091811  1.0
  F  F17  1  0.33261418  0.33381614  0.07908189  1.0
  F  F18  1  0.00158490  0.66777384  0.42084138  1.0
  F  F19  1  0.33411273  0.66703395  0.25000000  1.0
  F  F20  1  -0.00158490  0.33222616  0.57915862  1.0
  F  F21  1  0.33334654  0.00117830  0.92085683  1.0
  F  F22  1  0.33264351  0.66628599  0.75000000  1.0
  F  F23  1  -0.00100941  -0.00053843  0.75000000  1.0