# generated using pymatgen
data_MgScMn12P7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.47779749
_cell_length_b   9.47779779
_cell_length_c   3.45577282
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000256
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgScMn12P7
_chemical_formula_sum   'Mg1 Sc1 Mn12 P7'
_cell_volume   268.83800802
_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
  Mg  Mg0  1  0.66666700  0.33333300  0.50000000  1.0
  Sc  Sc1  1  0.00000000  0.00000000  0.00000000  1.0
  Mn  Mn2  1  0.38393429  0.28468757  0.00000000  1.0
  Mn  Mn3  1  0.90075328  0.61606571  0.00000000  1.0
  Mn  Mn4  1  0.71531243  0.09924672  0.00000000  1.0
  Mn  Mn5  1  0.61495432  0.78273063  0.00000000  1.0
  Mn  Mn6  1  0.16777831  0.38504568  0.00000000  1.0
  Mn  Mn7  1  0.21726937  0.83222169  0.00000000  1.0
  Mn  Mn8  1  0.76770900  0.71482428  0.50000000  1.0
  Mn  Mn9  1  0.94711529  0.23229100  0.50000000  1.0
  Mn  Mn10  1  0.28517572  0.05288471  0.50000000  1.0
  Mn  Mn11  1  0.41902570  0.53007086  0.50000000  1.0
  Mn  Mn12  1  0.11104516  0.58097430  0.50000000  1.0
  Mn  Mn13  1  0.46992914  0.88895484  0.50000000  1.0
  P  P14  1  0.62197704  0.53709392  0.00000000  1.0
  P  P15  1  0.91511689  0.37802296  0.00000000  1.0
  P  P16  1  0.46290608  0.08488311  0.00000000  1.0
  P  P17  1  0.75943423  0.95847805  0.50000000  1.0
  P  P18  1  0.19904382  0.24056577  0.50000000  1.0
  P  P19  1  0.04152195  0.80095618  0.50000000  1.0
  P  P20  1  0.33333300  0.66666700  0.00000000  1.0