The material structure described by Mn2SbN3 crystallizes in the orthorhombic Cmc2_1 space group. Mn(1) is bonded to one N(2) and three equivalent N(1) atoms to form distorted corner-sharing MnN4 tetrahedra. Sb(1) is bonded in a distorted bent 120 degrees geometry to two equivalent N(2) atoms. There are two inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to three equivalent Mn(1) atoms. In the second N site, N(2) is bonded to two equivalent Mn(1) and two equivalent Sb(1) atoms to form corner-sharing NMn2Sb2 trigonal pyramids. is represented by the CIF file [CIF]
data_Mn2SbN3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.407
_cell_length_b   5.966
_cell_length_c   5.420
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   123.478
_symmetry_Int_Tables_number   1
_cell_volume   145.832
_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
  Mn  Mn0  1  0.424  0.372  0.481  1.0
  Mn  Mn1  1  0.576  0.949  0.481  1.0
  Mn  Mn2  1  0.576  0.628  0.981  1.0
  Mn  Mn3  1  0.424  0.051  0.981  1.0
  Sb  Sb4  1  0.000  0.626  0.556  1.0
  Sb  Sb5  1  0.000  0.374  0.056  1.0
  N  N6  1  0.437  0.308  0.809  1.0
  N  N7  1  0.563  0.871  0.809  1.0
  N  N8  1  0.563  0.692  0.309  1.0
  N  N9  1  0.437  0.129  0.309  1.0
  N  N10  1  0.000  0.730  0.953  1.0
  N  N11  1  0.000  0.270  0.453  1.0
[/CIF]
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The material structure described by Mn2SbN3 crystallizes in the orthorhombic Cmc2_1 space group. Mn(1) is bonded to one N(2) and three equivalent N(1) atoms to form distorted corner-sharing MnN4 tetrahedra. Sb(1) is bonded in a distorted bent 120 degrees geometry to two equivalent N(2) atoms. There are two inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to three equivalent Mn(1) atoms. In the second N site, N(2) is bonded to two equivalent Mn(1) and two equivalent Sb(1) atoms to form corner-sharing NMn2Sb2 trigonal pyramids. is represented by the CIF file [CIF]
data_Mn2SbN3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.407
_cell_length_b   5.966
_cell_length_c   5.420
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   123.478
_symmetry_Int_Tables_number   1
_cell_volume   145.832
_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
  Mn  Mn0  1  0.424  0.372  0.481  1.0
  Mn  Mn1  1  0.576  0.949  0.481  1.0
  Mn  Mn2  1  0.576  0.628  0.981  1.0
  Mn  Mn3  1  0.424  0.051  0.981  1.0
  Sb  Sb4  1  0.000  0.626  0.556  1.0
  Sb  Sb5  1  0.000  0.374  0.056  1.0
  N  N6  1  0.437  0.308  0.809  1.0
  N  N7  1  0.563  0.871  0.809  1.0
  N  N8  1  0.563  0.692  0.309  1.0
  N  N9  1  0.437  0.129  0.309  1.0
  N  N10  1  0.000  0.730  0.953  1.0
  N  N11  1  0.000  0.270  0.453  1.0
[/CIF]
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