# generated using pymatgen
data_CoF3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.29447817
_cell_length_b   5.29447914
_cell_length_c   6.48409556
_cell_angle_alpha   90.00003394
_cell_angle_beta   89.99998015
_cell_angle_gamma   120.00004251
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoF3
_chemical_formula_sum   'Co3 F9'
_cell_volume   157.40780243
_cell_formula_units_Z   3
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
  Co  Co0  1  0.66666700  0.33333300  0.32994049  1.0
  Co  Co1  1  0.33333300  0.66666700  0.67009467  1.0
  Co  Co2  1  -0.00000000  0.00000000  0.99995441  1.0
  F  F3  1  0.67423112  0.83784107  0.83875698  1.0
  F  F4  1  0.16215893  0.83639005  0.83875698  1.0
  F  F5  1  0.16360995  0.32576888  0.83875698  1.0
  F  F6  1  0.50180867  0.50181224  0.50002598  1.0
  F  F7  1  0.49818676  -0.00000357  0.50002598  1.0
  F  F8  1  0.00000357  0.49819033  0.50002598  1.0
  F  F9  1  0.83784374  0.67423547  0.16121985  1.0
  F  F10  1  0.32576453  0.16360927  0.16121985  1.0
  F  F11  1  0.83639173  0.16215626  0.16121985  1.0