data_Mn2PW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38
_cell_length_b   4.38
_cell_length_c   2.87
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.55
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2PW
_chemical_formula_sum   'Mn2 P1 W1'
_cell_volume   51.77
_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
  Mn  Mn0  1  0.26  0.21  0.43  1.0
  Mn  Mn1  1  0.26  0.79  0.43  1.0
  P  P2  1  0.0  0.0  0.0  1.0
  W  W3  1  0.52  0.0  0.0  1.0

data_Mn2PW
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.87
_cell_length_b   4.38
_cell_length_c   4.38
_cell_angle_alpha   109.55
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2PW
_chemical_formula_sum   'Mn2 P1 W1'
_cell_volume   51.77
_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
  Mn  Mn0  1  0.43  0.26  0.21  1.0
  Mn  Mn1  1  0.43  0.26  0.79  1.0
  P  P2  1  0.0  0.0  0.0  1.0
  W  W3  1  0.0  0.52  0.0  1.0

Mn Mn P W
Mn Mn P W 0 2 o o o 0 2 o o + 0 3 o o o 0 1 o - o 1 2 o + o 1 3 o + o 1 3 o + + 2 3 - o o 
WMn2P crystallizes in the triclinic P1 space group. W(1) is bonded in a 6-coordinate geometry to two equivalent Mn(1), two equivalent Mn(2), and two equivalent P(1) atoms. There is one shorter (2.11 Å) and one longer (2.35 Å) W(1)-Mn(1) bond length. There is one shorter (1.74 Å) and one longer (2.03 Å) W(1)-Mn(2) bond length. There is one shorter (2.08 Å) and one longer (2.29 Å) W(1)-P(1) bond length. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a 6-coordinate geometry to two equivalent W(1), two equivalent Mn(2), and two equivalent P(1) atoms. There is one shorter (1.86 Å) and one longer (2.52 Å) Mn(1)-Mn(2) bond length. There is one shorter (1.74 Å) and one longer (2.03 Å) Mn(1)-P(1) bond length. In the second Mn site, Mn(2) is bonded in a 2-coordinate geometry to two equivalent W(1), two equivalent Mn(1), and two equivalent P(1) atoms. There is one shorter (2.11 Å) and one longer (2.35 Å) Mn(2)-P(1) bond length. P(1) is bonded in a 6-coordinate geometry to two equivalent W(1), two equivalent Mn(1), and two equivalent Mn(2) atoms.