data_KCrH4(C2O5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.97
_cell_length_b   4.97
_cell_length_c   10.08
_cell_angle_alpha   91.16
_cell_angle_beta   91.16
_cell_angle_gamma   94.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KCrH4(C2O5)2
_chemical_formula_sum   'K1 Cr1 H4 C4 O10'
_cell_volume   248.59
_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
  K  K0  1  0.0  0.0  0.0  1.0
  Cr  Cr1  1  0.23  0.0  0.04  1.0
  H  H2  1  0.93  0.18  0.0  1.0
  H  H3  1  0.93  0.82  0.0  1.0
  H  H4  1  0.53  0.82  0.08  1.0
  H  H5  1  0.53  0.18  0.08  1.0
  C  C6  1  0.18  0.78  0.49  1.0
  C  C7  1  0.18  0.22  0.49  1.0
  C  C8  1  0.29  0.22  0.59  1.0
  C  C9  1  0.29  0.78  0.59  1.0
  O  O10  1  0.72  0.31  0.6  1.0
  O  O11  1  0.72  0.69  0.6  1.0
  O  O12  1  0.74  0.69  0.48  1.0
  O  O13  1  0.74  0.31  0.48  1.0
  O  O14  1  0.6  0.41  0.52  1.0
  O  O15  1  0.6  0.59  0.52  1.0
  O  O16  1  0.86  0.59  0.56  1.0
  O  O17  1  0.86  0.41  0.56  1.0
  O  O18  1  0.3  0.0  0.44  1.0
  O  O19  1  0.17  0.0  0.64  1.0

data_KCrH4(C2O5)2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.97
_cell_length_b   4.97
_cell_length_c   10.08
_cell_angle_alpha   91.16
_cell_angle_beta   91.16
_cell_angle_gamma   94.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KCrH4(C2O5)2
_chemical_formula_sum   'K1 Cr1 H4 C4 O10'
_cell_volume   248.59
_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
  K  K0  1  0.0  0.0  0.0  1.0
  Cr  Cr1  1  0.23  0.0  0.04  1.0
  H  H2  1  0.53  0.18  0.08  1.0
  H  H3  1  0.53  0.82  0.08  1.0
  H  H4  1  0.93  0.18  0.0  1.0
  H  H5  1  0.93  0.82  0.0  1.0
  C  C6  1  0.18  0.22  0.49  1.0
  C  C7  1  0.18  0.78  0.49  1.0
  C  C8  1  0.29  0.22  0.59  1.0
  C  C9  1  0.29  0.78  0.59  1.0
  O  O10  1  0.17  0.0  0.64  1.0
  O  O11  1  0.3  0.0  0.44  1.0
  O  O12  1  0.6  0.41  0.52  1.0
  O  O13  1  0.6  0.59  0.52  1.0
  O  O14  1  0.72  0.31  0.6  1.0
  O  O15  1  0.72  0.69  0.6  1.0
  O  O16  1  0.74  0.31  0.48  1.0
  O  O17  1  0.74  0.69  0.48  1.0
  O  O18  1  0.86  0.41  0.56  1.0
  O  O19  1  0.86  0.59  0.56  1.0

K Cr H H H H C C C C O O O O O O O O O O