The crystal structure described by Nd2Mn5Co12 crystallizes in the hexagonal P6_3/mmc space group. There are two inequivalent Nd sites. In the first Nd site, Nd(1) is bonded in a 18-coordinate geometry to six equivalent Co(1) and twelve equivalent Co(2) atoms. In the second Nd site, Nd(2) is bonded in a 20-coordinate geometry to two equivalent Mn(1), six equivalent Mn(2), six equivalent Co(1), and six equivalent Co(2) atoms. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a 14-coordinate geometry to one Nd(2), one Mn(1), three equivalent Mn(2), three equivalent Co(2), and six equivalent Co(1) atoms. In the second Mn site, Mn(2) is bonded in a 8-coordinate geometry to two equivalent Nd(2), two equivalent Mn(1), four equivalent Co(1), and four equivalent Co(2) atoms. There are two inequivalent Co sites. In the first Co site, Co(1) is bonded in a 12-coordinate geometry to one Nd(1), one Nd(2), two equivalent Mn(1), two equivalent Mn(2), two equivalent Co(1), and four equivalent Co(2) atoms. In the second Co site, Co(2) is bonded in a 12-coordinate geometry to one Nd(2), two equivalent Nd(1), one Mn(1), two equivalent Mn(2), two equivalent Co(2), and four equivalent Co(1) atoms. is represented by the CIF card [CIF]
data_Nd2Mn5Co12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.387
_cell_length_b   8.387
_cell_length_c   8.235
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   501.641
_cell_formula_units_Z   2
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  0.000  0.000  0.250  1.0
  Nd  Nd1  1  0.000  0.000  0.750  1.0
  Nd  Nd2  1  0.333  0.667  0.750  1.0
  Nd  Nd3  1  0.667  0.333  0.250  1.0
  Mn  Mn4  1  0.333  0.667  0.385  1.0
  Mn  Mn5  1  0.667  0.333  0.615  1.0
  Mn  Mn6  1  0.667  0.333  0.885  1.0
  Mn  Mn7  1  0.333  0.667  0.115  1.0
  Mn  Mn8  1  0.500  0.000  0.000  1.0
  Mn  Mn9  1  0.000  0.500  0.000  1.0
  Mn  Mn10  1  0.500  0.500  0.000  1.0
  Mn  Mn11  1  0.500  0.000  0.500  1.0
  Mn  Mn12  1  0.000  0.500  0.500  1.0
  Mn  Mn13  1  0.500  0.500  0.500  1.0
  Co  Co14  1  0.330  0.377  0.250  1.0
  Co  Co15  1  0.623  0.953  0.250  1.0
  Co  Co16  1  0.047  0.670  0.250  1.0
  Co  Co17  1  0.623  0.670  0.250  1.0
  Co  Co18  1  0.047  0.377  0.250  1.0
  Co  Co19  1  0.330  0.953  0.250  1.0
  Co  Co20  1  0.670  0.623  0.750  1.0
  Co  Co21  1  0.377  0.047  0.750  1.0
  Co  Co22  1  0.953  0.330  0.750  1.0
  Co  Co23  1  0.377  0.330  0.750  1.0
  Co  Co24  1  0.953  0.623  0.750  1.0
  Co  Co25  1  0.670  0.047  0.750  1.0
  Co  Co26  1  0.166  0.834  0.512  1.0
  Co  Co27  1  0.166  0.332  0.512  1.0
  Co  Co28  1  0.668  0.834  0.512  1.0
  Co  Co29  1  0.834  0.166  0.488  1.0
  Co  Co30  1  0.834  0.668  0.488  1.0
  Co  Co31  1  0.332  0.166  0.488  1.0
  Co  Co32  1  0.834  0.166  0.012  1.0
  Co  Co33  1  0.834  0.668  0.012  1.0
  Co  Co34  1  0.332  0.166  0.012  1.0
  Co  Co35  1  0.166  0.834  0.988  1.0
  Co  Co36  1  0.166  0.332  0.988  1.0
  Co  Co37  1  0.668  0.834  0.988  1.0
[/CIF]
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The crystal structure described by Nd2Mn5Co12 crystallizes in the hexagonal P6_3/mmc space group. There are two inequivalent Nd sites. In the first Nd site, Nd(1) is bonded in a 18-coordinate geometry to six equivalent Co(1) and twelve equivalent Co(2) atoms. In the second Nd site, Nd(2) is bonded in a 20-coordinate geometry to two equivalent Mn(1), six equivalent Mn(2), six equivalent Co(1), and six equivalent Co(2) atoms. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a 14-coordinate geometry to one Nd(2), one Mn(1), three equivalent Mn(2), three equivalent Co(2), and six equivalent Co(1) atoms. In the second Mn site, Mn(2) is bonded in a 8-coordinate geometry to two equivalent Nd(2), two equivalent Mn(1), four equivalent Co(1), and four equivalent Co(2) atoms. There are two inequivalent Co sites. In the first Co site, Co(1) is bonded in a 12-coordinate geometry to one Nd(1), one Nd(2), two equivalent Mn(1), two equivalent Mn(2), two equivalent Co(1), and four equivalent Co(2) atoms. In the second Co site, Co(2) is bonded in a 12-coordinate geometry to one Nd(2), two equivalent Nd(1), one Mn(1), two equivalent Mn(2), two equivalent Co(2), and four equivalent Co(1) atoms. is represented by the CIF card [CIF]
data_Nd2Mn5Co12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.387
_cell_length_b   8.387
_cell_length_c   8.235
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   501.641
_cell_formula_units_Z   2
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  0.000  0.000  0.250  1.0
  Nd  Nd1  1  0.000  0.000  0.750  1.0
  Nd  Nd2  1  0.333  0.667  0.750  1.0
  Nd  Nd3  1  0.667  0.333  0.250  1.0
  Mn  Mn4  1  0.333  0.667  0.385  1.0
  Mn  Mn5  1  0.667  0.333  0.615  1.0
  Mn  Mn6  1  0.667  0.333  0.885  1.0
  Mn  Mn7  1  0.333  0.667  0.115  1.0
  Mn  Mn8  1  0.500  0.000  0.000  1.0
  Mn  Mn9  1  0.000  0.500  0.000  1.0
  Mn  Mn10  1  0.500  0.500  0.000  1.0
  Mn  Mn11  1  0.500  0.000  0.500  1.0
  Mn  Mn12  1  0.000  0.500  0.500  1.0
  Mn  Mn13  1  0.500  0.500  0.500  1.0
  Co  Co14  1  0.330  0.377  0.250  1.0
  Co  Co15  1  0.623  0.953  0.250  1.0
  Co  Co16  1  0.047  0.670  0.250  1.0
  Co  Co17  1  0.623  0.670  0.250  1.0
  Co  Co18  1  0.047  0.377  0.250  1.0
  Co  Co19  1  0.330  0.953  0.250  1.0
  Co  Co20  1  0.670  0.623  0.750  1.0
  Co  Co21  1  0.377  0.047  0.750  1.0
  Co  Co22  1  0.953  0.330  0.750  1.0
  Co  Co23  1  0.377  0.330  0.750  1.0
  Co  Co24  1  0.953  0.623  0.750  1.0
  Co  Co25  1  0.670  0.047  0.750  1.0
  Co  Co26  1  0.166  0.834  0.512  1.0
  Co  Co27  1  0.166  0.332  0.512  1.0
  Co  Co28  1  0.668  0.834  0.512  1.0
  Co  Co29  1  0.834  0.166  0.488  1.0
  Co  Co30  1  0.834  0.668  0.488  1.0
  Co  Co31  1  0.332  0.166  0.488  1.0
  Co  Co32  1  0.834  0.166  0.012  1.0
  Co  Co33  1  0.834  0.668  0.012  1.0
  Co  Co34  1  0.332  0.166  0.012  1.0
  Co  Co35  1  0.166  0.834  0.988  1.0
  Co  Co36  1  0.166  0.332  0.988  1.0
  Co  Co37  1  0.668  0.834  0.988  1.0
[/CIF]
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