# generated using pymatgen
data_ScMnFe4P3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.55357867
_cell_length_b   10.45214886
_cell_length_c   11.92769375
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScMnFe4P3
_chemical_formula_sum   'Sc4 Mn4 Fe16 P12'
_cell_volume   443.02476170
_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
  Sc  Sc0  1  0.25000000  0.58140124  0.70822450  1.0
  Sc  Sc1  1  0.25000000  0.91859876  0.20822450  1.0
  Sc  Sc2  1  0.75000000  0.41859876  0.29177550  1.0
  Sc  Sc3  1  0.75000000  0.08140124  0.79177550  1.0
  Mn  Mn4  1  0.25000000  0.70296890  0.98118887  1.0
  Mn  Mn5  1  0.25000000  0.79703110  0.48118887  1.0
  Mn  Mn6  1  0.75000000  0.29703110  0.01881113  1.0
  Mn  Mn7  1  0.75000000  0.20296890  0.51881113  1.0
  Fe  Fe8  1  0.25000000  0.40513033  0.48401714  1.0
  Fe  Fe9  1  0.25000000  0.09486967  0.98401714  1.0
  Fe  Fe10  1  0.75000000  0.59486967  0.51598286  1.0
  Fe  Fe11  1  0.75000000  0.90513033  0.01598286  1.0
  Fe  Fe12  1  0.25000000  0.22001357  0.17500339  1.0
  Fe  Fe13  1  0.25000000  0.27998743  0.67500339  1.0
  Fe  Fe14  1  0.75000000  0.77998743  0.82499661  1.0
  Fe  Fe15  1  0.75000000  0.72001257  0.32499661  1.0
  Fe  Fe16  1  0.25000000  0.87178501  0.70339506  1.0
  Fe  Fe17  1  0.25000000  0.62821499  0.20339506  1.0
  Fe  Fe18  1  0.75000000  0.12821499  0.29660494  1.0
  Fe  Fe19  1  0.75000000  0.37178501  0.79660494  1.0
  Fe  Fe20  1  0.25000000  0.45925556  0.93064057  1.0
  Fe  Fe21  1  0.25000000  0.04074444  0.43064057  1.0
  Fe  Fe22  1  0.75000000  0.54074444  0.06935943  1.0
  Fe  Fe23  1  0.75000000  0.95925556  0.56935943  1.0
  P  P24  1  0.25000000  0.43027643  0.11534576  1.0
  P  P25  1  0.25000000  0.06972357  0.61534576  1.0
  P  P26  1  0.75000000  0.56972357  0.88465424  1.0
  P  P27  1  0.75000000  0.93027643  0.38465424  1.0
  P  P28  1  0.25000000  0.26179088  0.86835514  1.0
  P  P29  1  0.25000000  0.23820912  0.36835514  1.0
  P  P30  1  0.75000000  0.73820912  0.13164486  1.0
  P  P31  1  0.75000000  0.76179088  0.63164486  1.0
  P  P32  1  0.25000000  0.58881470  0.39059346  1.0
  P  P33  1  0.25000000  0.91118530  0.89059346  1.0
  P  P34  1  0.75000000  0.41118530  0.60940654  1.0
  P  P35  1  0.75000000  0.08881470  0.10940654  1.0