# generated using pymatgen
data_Mn31Si11P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.84586501
_cell_length_b   6.84586501
_cell_length_c   12.36921257
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn31Si11P
_chemical_formula_sum   'Mn31 Si11 P1'
_cell_volume   502.02962675
_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  0.33333300  0.66666700  0.90985600  1
  Mn  Mn1  1  0.33333300  0.66666700  0.08585000  1
  Mn  Mn2  1  0.66478100  0.64625800  0.69320400  1
  Mn  Mn3  1  0.98147600  0.33521900  0.69320400  1
  Mn  Mn4  1  0.35374200  0.01852400  0.69320400  1
  Mn  Mn5  1  0.00958100  0.31649700  0.30835900  1
  Mn  Mn6  1  0.30691600  0.99041900  0.30835900  1
  Mn  Mn7  1  0.68350300  0.69308400  0.30835900  1
  Mn  Mn8  1  0.67268800  0.61012600  0.89844400  1
  Mn  Mn9  1  0.93743800  0.32731200  0.89844400  1
  Mn  Mn10  1  0.38987400  0.06256200  0.89844400  1
  Mn  Mn11  1  0.99038900  0.27025300  0.10225800  1
  Mn  Mn12  1  0.27986500  0.00961100  0.10225800  1
  Mn  Mn13  1  0.72974700  0.72013500  0.10225800  1
  Mn  Mn14  1  0.03924100  0.70607100  0.80426300  1
  Mn  Mn15  1  0.66683000  0.96075900  0.80426300  1
  Mn  Mn16  1  0.29392900  0.33317000  0.80426300  1
  Mn  Mn17  1  0.62615800  0.99813400  0.19519600  1
  Mn  Mn18  1  0.37197600  0.37384200  0.19519600  1
  Mn  Mn19  1  0.00186600  0.62802400  0.19519600  1
  Mn  Mn20  1  0.33333300  0.66666700  0.49854000  1
  Mn  Mn21  1  0.00000000  0.00000000  0.92430300  1
  Mn  Mn22  1  0.66666700  0.33333300  0.07310900  1
  Mn  Mn23  1  0.00000000  0.00000000  0.42769800  1
  Mn  Mn24  1  0.66666700  0.33333300  0.57187300  1
  Mn  Mn25  1  0.01774600  0.70464000  0.60178600  1
  Mn  Mn26  1  0.68689400  0.98225400  0.60178600  1
  Mn  Mn27  1  0.29536000  0.31310600  0.60178600  1
  Mn  Mn28  1  0.64935400  0.01901400  0.39781500  1
  Mn  Mn29  1  0.36966000  0.35064600  0.39781500  1
  Mn  Mn30  1  0.98098600  0.63034000  0.39781500  1
  Si  Si31  1  0.68446200  0.66518900  0.49997500  1
  Si  Si32  1  0.98072700  0.31553800  0.49997500  1
  Si  Si33  1  0.33481100  0.01927300  0.49997500  1
  Si  Si34  1  0.00000000  0.00000000  0.23180400  1
  Si  Si35  1  0.66666700  0.33333300  0.76769700  1
  Si  Si36  1  0.01473600  0.67054400  0.99922500  1
  Si  Si37  1  0.65580800  0.98526400  0.99922500  1
  Si  Si38  1  0.32945600  0.34419200  0.99922500  1
  Si  Si39  1  0.33333300  0.66666700  0.70787100  1
  Si  Si40  1  0.33333300  0.66666700  0.29102800  1
  Si  Si41  1  0.66666700  0.33333300  0.27748100  1
  P  P42  1  0.00000000  0.00000000  0.73128000  1
