The compound described by NdCO4 crystallizes in the orthorhombic Pnma space group. Nd(1) is bonded in a 8-coordinate geometry to two equivalent O(1), two equivalent O(2), and four equivalent O(3) atoms. C(1) is bonded in a trigonal planar geometry to one O(2) and two equivalent O(3) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to two equivalent Nd(1) atoms. In the second O site, O(2) is bonded in a 3-coordinate geometry to two equivalent Nd(1) and one C(1) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to two equivalent Nd(1) and one C(1) atom. is represented by the CIF card [CIF]
data_NdCO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.828
_cell_length_b   6.521
_cell_length_c   10.697
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   336.774
_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  0.750  0.319  0.394  1.0
  Nd  Nd1  1  0.750  0.819  0.106  1.0
  Nd  Nd2  1  0.250  0.681  0.606  1.0
  Nd  Nd3  1  0.250  0.181  0.894  1.0
  C  C4  1  0.750  0.273  0.107  1.0
  C  C5  1  0.750  0.773  0.393  1.0
  C  C6  1  0.250  0.727  0.893  1.0
  C  C7  1  0.250  0.227  0.607  1.0
  O  O8  1  0.750  0.735  0.638  1.0
  O  O9  1  0.750  0.235  0.862  1.0
  O  O10  1  0.250  0.265  0.362  1.0
  O  O11  1  0.250  0.765  0.138  1.0
  O  O12  1  0.750  0.451  0.161  1.0
  O  O13  1  0.750  0.951  0.339  1.0
  O  O14  1  0.250  0.549  0.839  1.0
  O  O15  1  0.250  0.049  0.661  1.0
  O  O16  1  0.521  0.175  0.088  1.0
  O  O17  1  0.979  0.675  0.412  1.0
  O  O18  1  0.021  0.825  0.912  1.0
  O  O19  1  0.479  0.325  0.588  1.0
  O  O20  1  0.479  0.825  0.912  1.0
  O  O21  1  0.021  0.325  0.588  1.0
  O  O22  1  0.979  0.175  0.088  1.0
  O  O23  1  0.521  0.675  0.412  1.0
[/CIF]
.
The compound described by NdCO4 crystallizes in the orthorhombic Pnma space group. Nd(1) is bonded in a 8-coordinate geometry to two equivalent O(1), two equivalent O(2), and four equivalent O(3) atoms. C(1) is bonded in a trigonal planar geometry to one O(2) and two equivalent O(3) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to two equivalent Nd(1) atoms. In the second O site, O(2) is bonded in a 3-coordinate geometry to two equivalent Nd(1) and one C(1) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to two equivalent Nd(1) and one C(1) atom. is represented by the CIF card [CIF]
data_NdCO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.828
_cell_length_b   6.521
_cell_length_c   10.697
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   336.774
_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  0.750  0.319  0.394  1.0
  Nd  Nd1  1  0.750  0.819  0.106  1.0
  Nd  Nd2  1  0.250  0.681  0.606  1.0
  Nd  Nd3  1  0.250  0.181  0.894  1.0
  C  C4  1  0.750  0.273  0.107  1.0
  C  C5  1  0.750  0.773  0.393  1.0
  C  C6  1  0.250  0.727  0.893  1.0
  C  C7  1  0.250  0.227  0.607  1.0
  O  O8  1  0.750  0.735  0.638  1.0
  O  O9  1  0.750  0.235  0.862  1.0
  O  O10  1  0.250  0.265  0.362  1.0
  O  O11  1  0.250  0.765  0.138  1.0
  O  O12  1  0.750  0.451  0.161  1.0
  O  O13  1  0.750  0.951  0.339  1.0
  O  O14  1  0.250  0.549  0.839  1.0
  O  O15  1  0.250  0.049  0.661  1.0
  O  O16  1  0.521  0.175  0.088  1.0
  O  O17  1  0.979  0.675  0.412  1.0
  O  O18  1  0.021  0.825  0.912  1.0
  O  O19  1  0.479  0.325  0.588  1.0
  O  O20  1  0.479  0.825  0.912  1.0
  O  O21  1  0.021  0.325  0.588  1.0
  O  O22  1  0.979  0.175  0.088  1.0
  O  O23  1  0.521  0.675  0.412  1.0
[/CIF]
.