The compound described by PuTcB2 is delta Molybdenum Boride-derived structured and crystallizes in the orthorhombic Pnma space group. Pu(1) is bonded in a 9-coordinate geometry to one Tc(1) and eight equivalent B(1) atoms. Tc(1) is bonded in a 7-coordinate geometry to one Pu(1) and six equivalent B(1) atoms. B(1) is bonded in a 9-coordinate geometry to four equivalent Pu(1), three equivalent Tc(1), and two equivalent B(1) atoms. is represented by the CIF card [CIF]
data_PuTcB2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.397
_cell_length_b   5.805
_cell_length_c   6.402
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   200.569
_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
  Pu  Pu0  1  0.250  0.001  0.340  1.0
  Pu  Pu1  1  0.250  0.501  0.160  1.0
  Pu  Pu2  1  0.750  0.999  0.660  1.0
  Pu  Pu3  1  0.750  0.499  0.840  1.0
  Tc  Tc4  1  0.250  0.188  0.816  1.0
  Tc  Tc5  1  0.250  0.688  0.684  1.0
  Tc  Tc6  1  0.750  0.812  0.184  1.0
  Tc  Tc7  1  0.750  0.312  0.316  1.0
  B  B8  1  0.083  0.371  0.536  1.0
  B  B9  1  0.417  0.871  0.964  1.0
  B  B10  1  0.583  0.629  0.464  1.0
  B  B11  1  0.917  0.129  0.036  1.0
  B  B12  1  0.917  0.629  0.464  1.0
  B  B13  1  0.583  0.129  0.036  1.0
  B  B14  1  0.417  0.371  0.536  1.0
  B  B15  1  0.083  0.871  0.964  1.0
[/CIF]
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The compound described by PuTcB2 is delta Molybdenum Boride-derived structured and crystallizes in the orthorhombic Pnma space group. Pu(1) is bonded in a 9-coordinate geometry to one Tc(1) and eight equivalent B(1) atoms. Tc(1) is bonded in a 7-coordinate geometry to one Pu(1) and six equivalent B(1) atoms. B(1) is bonded in a 9-coordinate geometry to four equivalent Pu(1), three equivalent Tc(1), and two equivalent B(1) atoms. is represented by the CIF card [CIF]
data_PuTcB2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.397
_cell_length_b   5.805
_cell_length_c   6.402
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   200.569
_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
  Pu  Pu0  1  0.250  0.001  0.340  1.0
  Pu  Pu1  1  0.250  0.501  0.160  1.0
  Pu  Pu2  1  0.750  0.999  0.660  1.0
  Pu  Pu3  1  0.750  0.499  0.840  1.0
  Tc  Tc4  1  0.250  0.188  0.816  1.0
  Tc  Tc5  1  0.250  0.688  0.684  1.0
  Tc  Tc6  1  0.750  0.812  0.184  1.0
  Tc  Tc7  1  0.750  0.312  0.316  1.0
  B  B8  1  0.083  0.371  0.536  1.0
  B  B9  1  0.417  0.871  0.964  1.0
  B  B10  1  0.583  0.629  0.464  1.0
  B  B11  1  0.917  0.129  0.036  1.0
  B  B12  1  0.917  0.629  0.464  1.0
  B  B13  1  0.583  0.129  0.036  1.0
  B  B14  1  0.417  0.371  0.536  1.0
  B  B15  1  0.083  0.871  0.964  1.0
[/CIF]
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