data_NaH5C6O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.0
_cell_length_b   11.0
_cell_length_c   11.0
_cell_angle_alpha   124.33
_cell_angle_beta   64.69
_cell_angle_gamma   149.72
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaH5C6O
_chemical_formula_sum   'Na4 H20 C24 O4'
_cell_volume   548.33
_cell_formula_units_Z   4
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
  Na  Na0  1  0.15  0.12  0.98  1.0
  Na  Na1  1  0.99  0.17  0.85  1.0
  Na  Na2  1  0.99  0.41  0.98  1.0
  Na  Na3  1  0.15  0.88  0.85  1.0
  H  H4  1  0.47  0.37  0.49  1.0
  H  H5  1  0.67  0.92  0.62  1.0
  H  H6  1  0.53  0.37  0.62  1.0
  H  H7  1  0.47  0.22  0.62  1.0
  H  H8  1  0.93  0.55  0.38  1.0
  H  H9  1  0.21  0.75  0.25  1.0
  H  H10  1  0.07  0.55  0.25  1.0
  H  H11  1  0.06  0.75  0.38  1.0
  H  H12  1  0.21  0.67  0.89  1.0
  H  H13  1  0.93  0.62  0.76  1.0
  H  H14  1  0.93  0.96  0.89  1.0
  H  H15  1  0.21  0.33  0.76  1.0
  H  H16  1  0.9  0.95  0.56  1.0
  H  H17  1  0.1  0.64  0.56  1.0
  H  H18  1  0.23  0.65  0.56  1.0
  H  H19  1  0.04  0.35  0.56  1.0
  H  H20  1  0.59  0.47  0.8  1.0
  H  H21  1  0.55  0.83  0.93  1.0
  H  H22  1  0.69  0.47  0.93  1.0
  H  H23  1  0.45  0.83  0.8  1.0
  C  C24  1  0.9  0.8  0.04  1.0
  C  C25  1  0.24  0.49  0.16  1.0
  C  C26  1  0.37  0.8  0.16  1.0
  C  C27  1  0.76  0.49  0.04  1.0
  C  C28  1  0.47  0.99  0.7  1.0
  C  C29  1  0.67  0.31  0.83  1.0
  C  C30  1  0.53  0.99  0.83  1.0
  C  C31  1  0.47  0.6  0.83  1.0
  C  C32  1  0.29  0.65  0.88  1.0
  C  C33  1  0.85  0.64  0.75  1.0
  C  C34  1  0.85  0.94  0.88  1.0
  C  C35  1  0.29  0.35  0.75  1.0
  C  C36  1  0.58  0.17  0.16  1.0
  C  C37  1  0.56  0.12  0.03  1.0
  C  C38  1  0.56  0.46  0.16  1.0
  C  C39  1  0.58  0.83  0.03  1.0
  C  C40  1  0.9  0.32  0.36  1.0
  C  C41  1  0.1  0.27  0.36  1.0
  C  C42  1  0.24  0.03  0.36  1.0
  C  C43  1  0.03  0.97  0.36  1.0
  C  C44  1  0.22  0.36  0.32  1.0
  C  C45  1  0.91  0.93  0.44  1.0
  C  C46  1  0.05  0.36  0.44  1.0
  C  C47  1  0.22  0.64  0.44  1.0
  O  O48  1  0.1  0.12  0.23  1.0
  O  O49  1  0.04  0.17  0.36  1.0
  O  O50  1  0.04  0.42  0.23  1.0
  O  O51  1  0.1  0.88  0.1  1.0

data_NaH5C6O
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.75
_cell_length_b   10.27
_cell_length_c   11.0
_cell_angle_alpha   117.83
_cell_angle_beta   105.14
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaH5C6O
_chemical_formula_sum   'Na4 H20 C24 O4'
_cell_volume   548.33
_cell_formula_units_Z   4
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
  Na  Na0  1  0.56  0.57  0.55  1.0
  Na  Na1  1  0.68  0.82  0.67  1.0
  Na  Na2  1  0.86  0.03  0.01  1.0
  Na  Na3  1  0.97  0.27  0.12  1.0
  H  H4  1  0.1  0.72  0.65  1.0
  H  H5  1  0.13  0.1  0.59  1.0
  H  H6  1  0.14  0.3  0.07  1.0
  H  H7  1  0.21  0.69  0.25  1.0
  H  H8  1  0.22  0.54  0.43  1.0
  H  H9  1  0.25  0.17  0.79  1.0
  H  H10  1  0.33  0.12  0.92  1.0
  H  H11  1  0.4  0.25  0.87  1.0
  H  H12  1  0.43  0.88  0.64  1.0
  H  H13  1  0.46  0.22  0.15  1.0
  H  H14  1  0.51  0.46  0.72  1.0
  H  H15  1  0.61  0.96  0.52  1.0
  H  H16  1  0.63  0.32  0.7  1.0
  H  H17  1  0.7  0.74  0.37  1.0
  H  H18  1  0.71  0.53  0.78  1.0
  H  H19  1  0.83  0.38  0.76  1.0
  H  H20  1  0.91  0.58  0.14  1.0
  H  H21  1  0.92  0.46  0.02  1.0
  H  H22  1  0.93  0.97  0.86  1.0
  H  H23  1  0.97  0.62  0.42  1.0
  C  C24  1  0.04  0.58  0.94  1.0
  C  C25  1  0.08  0.69  0.13  1.0
  C  C26  1  0.09  0.84  0.2  1.0
  C  C27  1  0.1  0.2  0.95  1.0
  C  C28  1  0.2  0.74  0.78  1.0
  C  C29  1  0.23  0.64  0.52  1.0
  C  C30  1  0.23  0.1  0.13  1.0
  C  C31  1  0.23  0.87  0.7  1.0
  C  C32  1  0.34  0.21  0.57  1.0
  C  C33  1  0.36  0.57  0.73  1.0
  C  C34  1  0.39  0.06  0.42  1.0
  C  C35  1  0.4  0.94  0.69  1.0
  C  C36  1  0.51  0.98  0.42  1.0
  C  C37  1  0.53  0.36  0.19  1.0
  C  C38  1  0.55  0.28  0.31  1.0
  C  C39  1  0.67  0.75  0.91  1.0
  C  C40  1  0.7  0.1  0.26  1.0
  C  C41  1  0.72  0.48  0.19  1.0
  C  C42  1  0.8  0.58  0.02  1.0
  C  C43  1  0.85  0.55  0.38  1.0
  C  C44  1  0.91  0.43  0.47  1.0
  C  C45  1  0.94  0.91  0.78  1.0
  C  C46  1  0.96  0.86  0.18  1.0
  C  C47  1  0.99  0.41  0.57  1.0
  O  O48  1  0.11  0.97  0.21  1.0
  O  O49  1  0.19  0.87  0.23  1.0
  O  O50  1  0.23  0.22  0.33  1.0
  O  O51  1  0.82  0.62  0.85  1.0

Na Na Na Na H H H H H H H H H H H H H H H H H H H H C C C C C C C C C C C C C C C C C C C C C C C C O O O O
Na Na Na Na H H H H H H H H H H H H H H H H H H H H C C C C C C C C C C C C C C C C C C C C C C C C O O O O 0 14 - - o 0 24 - - + 1 34 o - o 1 15 + o o 1 2 o o o 2 32 + o o 2 12 + o o 3 13 - o o 4 42 o o o 4 6 o o o 5 23 o o o 5 28 o o o 5 30 o o o 5 19 + + o 5 45 o o o 5 16 o o o 6 7 o o o 6 20 o o o 7 20 o o o 8 11 + o o 9 10 o o o 9 26 o o o 10 50 o o o 11 42 o + o 12 32 o o o 13 33 o o o 14 34 o o o 15 35 o o o 15 31 o o o 16 45 o o o 17 47 o o o 17 18 o o o 17 40 - o o 18 47 o o o 18 28 o o o 18 46 o o o 19 46 o o o 20 33 o o o 21 31 o o o 21 39 o o + 22 29 o o o 22 27 o o + 22 24 o o + 23 30 o o o 24 48 + + o 24 51 + o o 25 50 o o o 27 38 o o o 27 29 o o - 27 51 + o o 28 29 o + o 28 30 o o o 31 35 o o o 36 37 o o o 40 50 + o o 40 47 + o o 40 46 + o o 41 49 o o o 41 44 o o o 41 46 o o o 41 48 o o o 42 43 o - o 43 45 - o o 44 48 o o o 48 49 o o o 48 51 o - o 