# generated using pymatgen
data_CrSiH12(OF)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.41852226
_cell_length_b   6.41852226
_cell_length_c   6.41852247
_cell_angle_alpha   96.91522922
_cell_angle_beta   96.91522922
_cell_angle_gamma   96.91521851
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrSiH12(OF)6
_chemical_formula_sum   'Cr1 Si1 H12 O6 F6'
_cell_volume   258.14056063
_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
  Cr  Cr0  1  0.00000000  0.00000000  0.00000000  1.0
  Si  Si1  1  0.50000000  0.50000000  0.50000000  1.0
  H  H2  1  0.82609000  0.31746600  0.23441600  1.0
  H  H3  1  0.93729700  0.58831400  0.78970500  1.0
  H  H4  1  0.78970500  0.93729700  0.58831400  1.0
  H  H5  1  0.76558400  0.17391000  0.68253400  1.0
  H  H6  1  0.68253400  0.76558400  0.17391000  1.0
  H  H7  1  0.41168600  0.21029500  0.06270300  1.0
  H  H8  1  0.58831400  0.78970500  0.93729700  1.0
  H  H9  1  0.31746600  0.23441600  0.82609000  1.0
  H  H10  1  0.23441600  0.82609000  0.31746600  1.0
  H  H11  1  0.21029500  0.06270300  0.41168600  1.0
  H  H12  1  0.06270300  0.41168600  0.21029500  1.0
  H  H13  1  0.17391000  0.68253400  0.76558400  1.0
  O  O14  1  0.94006800  0.30781700  0.14574000  1.0
  O  O15  1  0.85426000  0.05993200  0.69218300  1.0
  O  O16  1  0.69218300  0.85426000  0.05993200  1.0
  O  O17  1  0.30781700  0.14574000  0.94006800  1.0
  O  O18  1  0.14574000  0.94006800  0.30781700  1.0
  O  O19  1  0.05993200  0.69218300  0.85426000  1.0
  F  F20  1  0.69659200  0.67671900  0.43338000  1.0
  F  F21  1  0.67671900  0.43338000  0.69659200  1.0
  F  F22  1  0.56662000  0.30340800  0.32328100  1.0
  F  F23  1  0.43338000  0.69659200  0.67671900  1.0
  F  F24  1  0.32328100  0.56662000  0.30340800  1.0
  F  F25  1  0.30340800  0.32328100  0.56662000  1.0