The material structure described by NdOHCO3 crystallizes in the orthorhombic P2_12_12_1 space group. Nd(1) is bonded in a 10-coordinate geometry to two equivalent O(1), two equivalent O(4), three equivalent O(2), and three equivalent O(3) atoms. C(1) is bonded in a trigonal planar geometry to one O(2), one O(3), and one O(4) atom. H(1) is bonded in a single-bond geometry to one O(1) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to two equivalent Nd(1) and one H(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to three equivalent Nd(1) and one C(1) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to three equivalent Nd(1) and one C(1) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to two equivalent Nd(1) and one C(1) atom. is represented by the CIF file [CIF]
data_NdHCO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.991
_cell_length_b   7.337
_cell_length_c   8.664
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   317.264
_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
  Nd  Nd0  1  0.752  0.142  0.336  1.0
  Nd  Nd1  1  0.748  0.642  0.164  1.0
  Nd  Nd2  1  0.252  0.858  0.664  1.0
  Nd  Nd3  1  0.248  0.358  0.836  1.0
  H  H4  1  0.855  0.503  0.473  1.0
  H  H5  1  0.645  0.003  0.027  1.0
  H  H6  1  0.355  0.497  0.527  1.0
  H  H7  1  0.145  0.997  0.973  1.0
  C  C8  1  0.251  0.304  0.176  1.0
  C  C9  1  0.249  0.804  0.324  1.0
  C  C10  1  0.751  0.696  0.824  1.0
  C  C11  1  0.749  0.196  0.676  1.0
  O  O12  1  0.742  0.460  0.388  1.0
  O  O13  1  0.758  0.960  0.112  1.0
  O  O14  1  0.242  0.540  0.612  1.0
  O  O15  1  0.258  0.040  0.888  1.0
  O  O16  1  0.028  0.348  0.109  1.0
  O  O17  1  0.472  0.848  0.391  1.0
  O  O18  1  0.528  0.652  0.891  1.0
  O  O19  1  0.972  0.152  0.609  1.0
  O  O20  1  0.978  0.652  0.887  1.0
  O  O21  1  0.522  0.152  0.613  1.0
  O  O22  1  0.478  0.348  0.113  1.0
  O  O23  1  0.022  0.848  0.387  1.0
  O  O24  1  0.249  0.207  0.301  1.0
  O  O25  1  0.251  0.707  0.199  1.0
  O  O26  1  0.749  0.793  0.699  1.0
  O  O27  1  0.751  0.293  0.801  1.0
[/CIF]
.
The material structure described by NdOHCO3 crystallizes in the orthorhombic P2_12_12_1 space group. Nd(1) is bonded in a 10-coordinate geometry to two equivalent O(1), two equivalent O(4), three equivalent O(2), and three equivalent O(3) atoms. C(1) is bonded in a trigonal planar geometry to one O(2), one O(3), and one O(4) atom. H(1) is bonded in a single-bond geometry to one O(1) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to two equivalent Nd(1) and one H(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to three equivalent Nd(1) and one C(1) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to three equivalent Nd(1) and one C(1) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to two equivalent Nd(1) and one C(1) atom. is represented by the CIF file [CIF]
data_NdHCO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.991
_cell_length_b   7.337
_cell_length_c   8.664
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   317.264
_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
  Nd  Nd0  1  0.752  0.142  0.336  1.0
  Nd  Nd1  1  0.748  0.642  0.164  1.0
  Nd  Nd2  1  0.252  0.858  0.664  1.0
  Nd  Nd3  1  0.248  0.358  0.836  1.0
  H  H4  1  0.855  0.503  0.473  1.0
  H  H5  1  0.645  0.003  0.027  1.0
  H  H6  1  0.355  0.497  0.527  1.0
  H  H7  1  0.145  0.997  0.973  1.0
  C  C8  1  0.251  0.304  0.176  1.0
  C  C9  1  0.249  0.804  0.324  1.0
  C  C10  1  0.751  0.696  0.824  1.0
  C  C11  1  0.749  0.196  0.676  1.0
  O  O12  1  0.742  0.460  0.388  1.0
  O  O13  1  0.758  0.960  0.112  1.0
  O  O14  1  0.242  0.540  0.612  1.0
  O  O15  1  0.258  0.040  0.888  1.0
  O  O16  1  0.028  0.348  0.109  1.0
  O  O17  1  0.472  0.848  0.391  1.0
  O  O18  1  0.528  0.652  0.891  1.0
  O  O19  1  0.972  0.152  0.609  1.0
  O  O20  1  0.978  0.652  0.887  1.0
  O  O21  1  0.522  0.152  0.613  1.0
  O  O22  1  0.478  0.348  0.113  1.0
  O  O23  1  0.022  0.848  0.387  1.0
  O  O24  1  0.249  0.207  0.301  1.0
  O  O25  1  0.251  0.707  0.199  1.0
  O  O26  1  0.749  0.793  0.699  1.0
  O  O27  1  0.751  0.293  0.801  1.0
[/CIF]
.