The material described by NaClO3 crystallizes in the triclinic P1 space group. There are four inequivalent Na sites. In the first Na site, Na(1) is bonded in a 6-coordinate geometry to one O(10), one O(11), one O(12), one O(8), one Cl(2), and one Cl(4) atom. In the second Na site, Na(2) is bonded in a 6-coordinate geometry to one O(1), one O(5), one O(6), one O(7), one Cl(3), and one Cl(4) atom. In the third Na site, Na(3) is bonded in a 9-coordinate geometry to one O(12), one O(2), one O(5), one O(6), one O(8), one O(9), one Cl(1), one Cl(2), and one Cl(3) atom. In the fourth Na site, Na(4) is bonded in a 8-coordinate geometry to one O(1), one O(2), one O(3), one O(4), one O(9), one Cl(1), one Cl(3), and one Cl(4) atom. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Na(2), one Na(4), and one O(4) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one Na(3), one Na(4), and one O(12) atom. In the third O site, O(3) is bonded in a distorted bent 120 degrees geometry to one Na(4) and one O(11) atom. In the fourth O site, O(4) is bonded in an L-shaped geometry to one Na(4) and one O(1) atom. In the fifth O site, O(5) is bonded in a 3-coordinate geometry to one Na(2), one Na(3), and one O(9) atom. In the sixth O site, O(6) is bonded in a 2-coordinate geometry to one Na(2), one Na(3), and one O(8) atom. In the seventh O site, O(7) is bonded in an L-shaped geometry to one Na(2) and one O(10) atom. In the eighth O site, O(8) is bonded in a 3-coordinate geometry to one Na(1), one Na(3), and one O(6) atom. In the ninth O site, O(9) is bonded in a 2-coordinate geometry to one Na(3), one Na(4), and one O(5) atom. In the tenth O site, O(10) is bonded in a distorted bent 120 degrees geometry to one Na(1) and one O(7) atom. In the eleventh O site, O(11) is bonded in an L-shaped geometry to one Na(1) and one O(3) atom. In the twelfth O site, O(12) is bonded in a distorted bent 120 degrees geometry to one Na(1), one Na(3), and one O(2) atom. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a distorted linear geometry to one Na(3) and one Na(4) atom. In the second Cl site, Cl(2) is bonded in a distorted linear geometry to one Na(1) and one Na(3) atom. In the third Cl site, Cl(3) is bonded in a distorted linear geometry to one Na(2), one Na(3), and one Na(4) atom. In the fourth Cl site, Cl(4) is bonded in a trigonal non-coplanar geometry to one Na(1), one Na(2), and one Na(4) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaClO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.295
_cell_length_b   7.302
_cell_length_c   7.309
_cell_angle_alpha   87.779
_cell_angle_beta   88.271
_cell_angle_gamma   87.961
_symmetry_Int_Tables_number   1
_cell_volume   388.611
_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  0.409  0.537  0.974  1.0
  Na  Na1  1  0.477  0.910  0.538  1.0
  Na  Na2  1  0.950  0.451  0.447  1.0
  Na  Na3  1  0.043  0.979  0.902  1.0
  Cl  Cl4  1  0.010  0.699  0.156  1.0
  Cl  Cl5  1  0.661  0.512  0.687  1.0
  Cl  Cl6  1  0.193  0.163  0.515  1.0
  Cl  Cl7  1  0.381  0.880  0.878  1.0
  O  O8  1  0.722  0.101  0.737  1.0
  O  O9  1  0.996  0.362  0.835  1.0
  O  O10  1  0.232  0.215  0.109  1.0
  O  O11  1  0.710  0.118  0.905  1.0
  O  O12  1  0.864  0.833  0.503  1.0
  O  O13  1  0.318  0.607  0.483  1.0
  O  O14  1  0.605  0.899  0.214  1.0
  O  O15  1  0.331  0.500  0.356  1.0
  O  O16  1  0.982  0.807  0.620  1.0
  O  O17  1  0.606  0.729  0.221  1.0
  O  O18  1  0.402  0.213  0.110  1.0
  O  O19  1  0.107  0.486  0.812  1.0
[/CIF]
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The material described by NaClO3 crystallizes in the triclinic P1 space group. There are four inequivalent Na sites. In the first Na site, Na(1) is bonded in a 6-coordinate geometry to one O(10), one O(11), one O(12), one O(8), one Cl(2), and one Cl(4) atom. In the second Na site, Na(2) is bonded in a 6-coordinate geometry to one O(1), one O(5), one O(6), one O(7), one Cl(3), and one Cl(4) atom. In the third Na site, Na(3) is bonded in a 9-coordinate geometry to one O(12), one O(2), one O(5), one O(6), one O(8), one O(9), one Cl(1), one Cl(2), and one Cl(3) atom. In the fourth Na site, Na(4) is bonded in a 8-coordinate geometry to one O(1), one O(2), one O(3), one O(4), one O(9), one Cl(1), one Cl(3), and one Cl(4) atom. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Na(2), one Na(4), and one O(4) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one Na(3), one Na(4), and one O(12) atom. In the third O site, O(3) is bonded in a distorted bent 120 degrees geometry to one Na(4) and one O(11) atom. In the fourth O site, O(4) is bonded in an L-shaped geometry to one Na(4) and one O(1) atom. In the fifth O site, O(5) is bonded in a 3-coordinate geometry to one Na(2), one Na(3), and one O(9) atom. In the sixth O site, O(6) is bonded in a 2-coordinate geometry to one Na(2), one Na(3), and one O(8) atom. In the seventh O site, O(7) is bonded in an L-shaped geometry to one Na(2) and one O(10) atom. In the eighth O site, O(8) is bonded in a 3-coordinate geometry to one Na(1), one Na(3), and one O(6) atom. In the ninth O site, O(9) is bonded in a 2-coordinate geometry to one Na(3), one Na(4), and one O(5) atom. In the tenth O site, O(10) is bonded in a distorted bent 120 degrees geometry to one Na(1) and one O(7) atom. In the eleventh O site, O(11) is bonded in an L-shaped geometry to one Na(1) and one O(3) atom. In the twelfth O site, O(12) is bonded in a distorted bent 120 degrees geometry to one Na(1), one Na(3), and one O(2) atom. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a distorted linear geometry to one Na(3) and one Na(4) atom. In the second Cl site, Cl(2) is bonded in a distorted linear geometry to one Na(1) and one Na(3) atom. In the third Cl site, Cl(3) is bonded in a distorted linear geometry to one Na(2), one Na(3), and one Na(4) atom. In the fourth Cl site, Cl(4) is bonded in a trigonal non-coplanar geometry to one Na(1), one Na(2), and one Na(4) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaClO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.295
_cell_length_b   7.302
_cell_length_c   7.309
_cell_angle_alpha   87.779
_cell_angle_beta   88.271
_cell_angle_gamma   87.961
_symmetry_Int_Tables_number   1
_cell_volume   388.611
_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  0.409  0.537  0.974  1.0
  Na  Na1  1  0.477  0.910  0.538  1.0
  Na  Na2  1  0.950  0.451  0.447  1.0
  Na  Na3  1  0.043  0.979  0.902  1.0
  Cl  Cl4  1  0.010  0.699  0.156  1.0
  Cl  Cl5  1  0.661  0.512  0.687  1.0
  Cl  Cl6  1  0.193  0.163  0.515  1.0
  Cl  Cl7  1  0.381  0.880  0.878  1.0
  O  O8  1  0.722  0.101  0.737  1.0
  O  O9  1  0.996  0.362  0.835  1.0
  O  O10  1  0.232  0.215  0.109  1.0
  O  O11  1  0.710  0.118  0.905  1.0
  O  O12  1  0.864  0.833  0.503  1.0
  O  O13  1  0.318  0.607  0.483  1.0
  O  O14  1  0.605  0.899  0.214  1.0
  O  O15  1  0.331  0.500  0.356  1.0
  O  O16  1  0.982  0.807  0.620  1.0
  O  O17  1  0.606  0.729  0.221  1.0
  O  O18  1  0.402  0.213  0.110  1.0
  O  O19  1  0.107  0.486  0.812  1.0
[/CIF]
.