The material described by CoH3(CN)6 crystallizes in the trigonal P-31m space group. Co(1) is bonded in an octahedral geometry to six equivalent C(1) atoms. C(1) is bonded in a linear geometry to one Co(1) and one N(1) atom. N(1) is bonded in a linear geometry to one C(1) and one H(1) atom. H(1) is bonded in a linear geometry to two equivalent N(1) atoms. is represented by the CIF file [CIF]
data_CoH3(CN)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.486
_cell_length_b   6.486
_cell_length_c   5.591
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   203.719
_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
  Co  Co0  1  0.000  0.000  0.000  1.0
  H  H1  1  0.000  0.500  0.500  1.0
  H  H2  1  0.500  0.000  0.500  1.0
  H  H3  1  0.500  0.500  0.500  1.0
  C  C4  1  0.235  0.235  0.805  1.0
  C  C5  1  0.235  0.000  0.195  1.0
  C  C6  1  0.000  0.765  0.805  1.0
  C  C7  1  0.000  0.235  0.195  1.0
  C  C8  1  0.765  0.765  0.195  1.0
  C  C9  1  0.765  0.000  0.805  1.0
  N  N10  1  0.000  0.623  0.677  1.0
  N  N11  1  0.000  0.377  0.323  1.0
  N  N12  1  0.377  0.000  0.323  1.0
  N  N13  1  0.623  0.000  0.677  1.0
  N  N14  1  0.623  0.623  0.323  1.0
  N  N15  1  0.377  0.377  0.677  1.0
[/CIF]
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The material described by CoH3(CN)6 crystallizes in the trigonal P-31m space group. Co(1) is bonded in an octahedral geometry to six equivalent C(1) atoms. C(1) is bonded in a linear geometry to one Co(1) and one N(1) atom. N(1) is bonded in a linear geometry to one C(1) and one H(1) atom. H(1) is bonded in a linear geometry to two equivalent N(1) atoms. is represented by the CIF file [CIF]
data_CoH3(CN)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.486
_cell_length_b   6.486
_cell_length_c   5.591
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   203.719
_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
  Co  Co0  1  0.000  0.000  0.000  1.0
  H  H1  1  0.000  0.500  0.500  1.0
  H  H2  1  0.500  0.000  0.500  1.0
  H  H3  1  0.500  0.500  0.500  1.0
  C  C4  1  0.235  0.235  0.805  1.0
  C  C5  1  0.235  0.000  0.195  1.0
  C  C6  1  0.000  0.765  0.805  1.0
  C  C7  1  0.000  0.235  0.195  1.0
  C  C8  1  0.765  0.765  0.195  1.0
  C  C9  1  0.765  0.000  0.805  1.0
  N  N10  1  0.000  0.623  0.677  1.0
  N  N11  1  0.000  0.377  0.323  1.0
  N  N12  1  0.377  0.000  0.323  1.0
  N  N13  1  0.623  0.000  0.677  1.0
  N  N14  1  0.623  0.623  0.323  1.0
  N  N15  1  0.377  0.377  0.677  1.0
[/CIF]
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