The material described by MnP4 is Sylvanite-derived structured and crystallizes in the monoclinic Cc space group. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one P(1), one P(2), one P(5), one P(6), one P(7), and one P(8) atom to form edge-sharing MnP6 octahedra. In the second Mn site, Mn(2) is bonded to one P(1), one P(2), one P(3), one P(4), one P(5), and one P(6) atom to form edge-sharing MnP6 octahedra. There are eight inequivalent P sites. In the first P site, P(1) is bonded in a 4-coordinate geometry to one Mn(1), one Mn(2), one P(2), and one P(3) atom. In the second P site, P(2) is bonded in a 4-coordinate geometry to one Mn(1), one Mn(2), one P(1), and one P(4) atom. In the third P site, P(3) is bonded in a distorted single-bond geometry to one Mn(2), one P(1), one P(4), and one P(7) atom. In the fourth P site, P(4) is bonded in a distorted single-bond geometry to one Mn(2), one P(2), one P(3), and one P(8) atom. In the fifth P site, P(5) is bonded in a 4-coordinate geometry to one Mn(1), one Mn(2), one P(6), and one P(8) atom. In the sixth P site, P(6) is bonded in a 4-coordinate geometry to one Mn(1), one Mn(2), one P(5), and one P(7) atom. In the seventh P site, P(7) is bonded in a distorted single-bond geometry to one Mn(1), one P(3), one P(6), and one P(8) atom. In the eighth P site, P(8) is bonded in a distorted single-bond geometry to one Mn(1), one P(4), one P(5), and one P(7) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_MnP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.104
_cell_length_b   5.858
_cell_length_c   10.882
_cell_angle_alpha   88.365
_cell_angle_beta   86.245
_cell_angle_gamma   64.178
_symmetry_Int_Tables_number   1
_cell_volume   292.260
_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
  Mn  Mn0  1  0.015  0.544  0.976  1.0
  Mn  Mn1  1  0.560  0.456  0.476  1.0
  Mn  Mn2  1  0.906  0.200  0.254  1.0
  Mn  Mn3  1  0.106  0.800  0.754  1.0
  P  P4  1  0.056  0.506  0.194  1.0
  P  P5  1  0.562  0.494  0.694  1.0
  P  P6  1  0.449  0.507  0.275  1.0
  P  P7  1  0.956  0.493  0.775  1.0
  P  P8  1  0.773  0.889  0.276  1.0
  P  P9  1  0.662  0.111  0.776  1.0
  P  P10  1  0.368  0.900  0.211  1.0
  P  P11  1  0.268  0.100  0.711  1.0
  P  P12  1  0.009  0.144  0.451  1.0
  P  P13  1  0.154  0.856  0.951  1.0
  P  P14  1  0.873  0.231  0.042  1.0
  P  P15  1  0.104  0.769  0.542  1.0
  P  P16  1  0.712  0.760  0.466  1.0
  P  P17  1  0.472  0.240  0.966  1.0
  P  P18  1  0.559  0.836  0.017  1.0
  P  P19  1  0.395  0.164  0.517  1.0
[/CIF]
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The material described by MnP4 is Sylvanite-derived structured and crystallizes in the monoclinic Cc space group. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one P(1), one P(2), one P(5), one P(6), one P(7), and one P(8) atom to form edge-sharing MnP6 octahedra. In the second Mn site, Mn(2) is bonded to one P(1), one P(2), one P(3), one P(4), one P(5), and one P(6) atom to form edge-sharing MnP6 octahedra. There are eight inequivalent P sites. In the first P site, P(1) is bonded in a 4-coordinate geometry to one Mn(1), one Mn(2), one P(2), and one P(3) atom. In the second P site, P(2) is bonded in a 4-coordinate geometry to one Mn(1), one Mn(2), one P(1), and one P(4) atom. In the third P site, P(3) is bonded in a distorted single-bond geometry to one Mn(2), one P(1), one P(4), and one P(7) atom. In the fourth P site, P(4) is bonded in a distorted single-bond geometry to one Mn(2), one P(2), one P(3), and one P(8) atom. In the fifth P site, P(5) is bonded in a 4-coordinate geometry to one Mn(1), one Mn(2), one P(6), and one P(8) atom. In the sixth P site, P(6) is bonded in a 4-coordinate geometry to one Mn(1), one Mn(2), one P(5), and one P(7) atom. In the seventh P site, P(7) is bonded in a distorted single-bond geometry to one Mn(1), one P(3), one P(6), and one P(8) atom. In the eighth P site, P(8) is bonded in a distorted single-bond geometry to one Mn(1), one P(4), one P(5), and one P(7) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_MnP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.104
_cell_length_b   5.858
_cell_length_c   10.882
_cell_angle_alpha   88.365
_cell_angle_beta   86.245
_cell_angle_gamma   64.178
_symmetry_Int_Tables_number   1
_cell_volume   292.260
_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
  Mn  Mn0  1  0.015  0.544  0.976  1.0
  Mn  Mn1  1  0.560  0.456  0.476  1.0
  Mn  Mn2  1  0.906  0.200  0.254  1.0
  Mn  Mn3  1  0.106  0.800  0.754  1.0
  P  P4  1  0.056  0.506  0.194  1.0
  P  P5  1  0.562  0.494  0.694  1.0
  P  P6  1  0.449  0.507  0.275  1.0
  P  P7  1  0.956  0.493  0.775  1.0
  P  P8  1  0.773  0.889  0.276  1.0
  P  P9  1  0.662  0.111  0.776  1.0
  P  P10  1  0.368  0.900  0.211  1.0
  P  P11  1  0.268  0.100  0.711  1.0
  P  P12  1  0.009  0.144  0.451  1.0
  P  P13  1  0.154  0.856  0.951  1.0
  P  P14  1  0.873  0.231  0.042  1.0
  P  P15  1  0.104  0.769  0.542  1.0
  P  P16  1  0.712  0.760  0.466  1.0
  P  P17  1  0.472  0.240  0.966  1.0
  P  P18  1  0.559  0.836  0.017  1.0
  P  P19  1  0.395  0.164  0.517  1.0
[/CIF]
.