[CIF]
data_Sc2Mn12P7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.08895461
_cell_length_b   3.56974917
_cell_length_c   9.10717985
_cell_angle_alpha   90.00000000
_cell_angle_beta   119.78004865
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2Mn12P7
_chemical_formula_sum   'Sc2 Mn12 P7'
_cell_volume   256.46285939
_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  0.88697059  0.00000000  7.52053736  1
  Mn  Mn1  1  -2.36575030  0.00000000  4.90399260  1
  Mn  Mn2  1  1.50710698  0.00000000  3.36121672  1
  Mn  Mn3  1  4.35059363  0.00000000  5.69547833  1
  Mn  Mn4  1  1.99942031  0.00000000  0.95648968  1
  Mn  Mn5  1  7.29437412  0.00000000  1.23976104  1
  Mn  Mn6  1  2.97876177  1.78487458  4.45769151  1
  Mn  Mn7  1  3.75328746  1.78487458  0.33673152  1
  Mn  Mn8  1  6.90959753  1.78487458  3.10871731  1
  Mn  Mn9  1  2.99591404  1.78487458  7.11130160  1
  Mn  Mn10  1  -3.06710619  1.78487458  6.94362017  1
  Mn  Mn11  1  0.14047343  1.78487458  1.73287289  1
  P  P12  1  2.07094551  0.00000000  5.60121901  1
  P  P13  1  -1.37412709  0.00000000  6.90168774  1
  P  P14  1  -0.73400416  0.00000000  3.27166878  1
  P  P15  1  5.27310405  1.78487458  4.70964164  1
  P  P16  1  2.50963675  1.78487458  2.24847809  1
  P  P17  1  5.92679714  1.78487458  1.04588032  1
  P  P18  1  -4.48611347  0.00000000  7.87218311  1
  Sc  Sc19  1  4.56525364  0.00000000  2.65163737  1
  Sc  Sc20  1  -0.00285864  1.78487458  5.28253870  1
[/CIF]
