# generated using pymatgen
data_Mn6Al31Cu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.80580949
_cell_length_b   23.94882260
_cell_length_c   12.55324989
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn6Al31Cu2
_chemical_formula_sum   'Mn24 Al124 Cu8'
_cell_volume   2346.70386567
_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
  Mn  Mn0  1  0.00000000  0.64219200  0.05141800  1
  Mn  Mn1  1  0.50000000  0.85780800  0.94858200  1
  Mn  Mn2  1  0.50000000  0.85780800  0.55141800  1
  Mn  Mn3  1  0.00000000  0.64219200  0.44858200  1
  Mn  Mn4  1  0.50000000  0.58850500  0.57095100  1
  Mn  Mn5  1  0.00000000  0.91149500  0.42904900  1
  Mn  Mn6  1  0.00000000  0.91149500  0.07095100  1
  Mn  Mn7  1  0.50000000  0.58850500  0.92904900  1
  Mn  Mn8  1  0.50000000  0.95861100  0.25000000  1
  Mn  Mn9  1  0.00000000  0.54138900  0.75000000  1
  Mn  Mn10  1  0.50000000  0.58120800  0.25000000  1
  Mn  Mn11  1  0.00000000  0.91879200  0.75000000  1
  Mn  Mn12  1  0.50000000  0.14219200  0.05141800  1
  Mn  Mn13  1  0.00000000  0.35780800  0.94858200  1
  Mn  Mn14  1  0.00000000  0.35780800  0.55141800  1
  Mn  Mn15  1  0.50000000  0.14219200  0.44858200  1
  Mn  Mn16  1  0.00000000  0.08850500  0.57095100  1
  Mn  Mn17  1  0.50000000  0.41149500  0.42904900  1
  Mn  Mn18  1  0.50000000  0.41149500  0.07095100  1
  Mn  Mn19  1  0.00000000  0.08850500  0.92904900  1
  Mn  Mn20  1  0.00000000  0.45861100  0.25000000  1
  Mn  Mn21  1  0.50000000  0.04138900  0.75000000  1
  Mn  Mn22  1  0.00000000  0.08120800  0.25000000  1
  Mn  Mn23  1  0.50000000  0.41879200  0.75000000  1
  Al  Al24  1  0.00000000  0.80166100  0.25000000  1
  Al  Al25  1  0.50000000  0.69833900  0.75000000  1
  Al  Al26  1  0.81583400  0.71784800  0.12648700  1
  Al  Al27  1  0.68416600  0.78215200  0.87351300  1
  Al  Al28  1  0.68416600  0.78215200  0.62648700  1
  Al  Al29  1  0.18416600  0.71784800  0.37351300  1
  Al  Al30  1  0.81583400  0.71784800  0.37351300  1
  Al  Al31  1  0.31583400  0.78215200  0.62648700  1
  Al  Al32  1  0.31583400  0.78215200  0.87351300  1
  Al  Al33  1  0.18416600  0.71784800  0.12648700  1
  Al  Al34  1  0.69372200  0.94646200  0.06844900  1
  Al  Al35  1  0.80627800  0.55353800  0.93155100  1
  Al  Al36  1  0.80627800  0.55353800  0.56844900  1
  Al  Al37  1  0.30627800  0.94646200  0.43155100  1
  Al  Al38  1  0.69372200  0.94646200  0.43155100  1
  Al  Al39  1  0.19372200  0.55353800  0.56844900  1
  Al  Al40  1  0.19372200  0.55353800  0.93155100  1
  Al  Al41  1  0.30627800  0.94646200  0.06844900  1
  Al  Al42  1  0.50000000  0.51561400  0.09400700  1
  Al  Al43  1  0.00000000  0.98438600  0.90599300  1
  Al  Al44  1  0.00000000  0.98438600  0.59400700  1
  Al  Al45  1  0.50000000  0.51561400  0.40599300  1
  Al  Al46  1  0.50000000  0.75841700  0.05496800  1
  Al  Al47  1  0.00000000  0.74158300  0.94503200  1
  Al  Al48  1  0.00000000  0.74158300  0.55496800  1
  Al  Al49  1  0.50000000  0.75841700  0.44503200  1
  Al  Al50  1  0.73934000  0.51639600  0.25000000  1
  Al  Al51  1  0.76066000  0.98360400  0.75000000  1
  Al  Al52  1  0.26066000  0.51639600  0.25000000  1
  Al  Al53  1  0.23934000  0.98360400  0.75000000  1
  Al  Al54  1  0.69107600  0.60967400  0.10625700  1
  Al  Al55  1  0.80892400  0.89032600  0.89374300  1
  Al  Al56  1  0.80892400  0.89032600  0.60625700  1
  Al  Al57  1  0.30892400  0.60967400  0.39374300  1
  Al  Al58  1  0.69107600  0.60967400  0.39374300  1
  Al  Al59  1  0.19107600  0.89032600  0.60625700  1
  Al  Al60  1  0.19107600  0.89032600  0.89374300  1
  Al  Al61  1  0.30892400  0.60967400  0.10625700  1
  Al  Al62  1  0.82650500  0.90365100  0.25000000  1
  Al  Al63  1  0.67349500  0.59634900  0.75000000  1
  Al  Al64  1  0.17349500  0.90365100  0.25000000  1
  Al  Al65  1  0.32650500  0.59634900  0.75000000  1
  Al  Al66  1  0.00000000  0.63629300  0.25000000  1
  Al  Al67  1  0.50000000  0.86370700  0.75000000  1
  Al  Al68  1  0.00000000  0.53961100  0.11139100  1
  Al  Al69  1  0.50000000  0.96038900  0.88860900  1
  Al  Al70  1  0.50000000  0.96038900  0.61139100  1
  Al  Al71  1  0.00000000  0.53961100  0.38860900  1
  Al  Al72  1  0.50000000  0.86442900  0.14904700  1
  Al  Al73  1  0.00000000  0.63557100  0.85095300  1
  Al  Al74  1  0.00000000  0.63557100  0.64904700  1
  Al  Al75  1  0.50000000  0.86442900  0.35095300  1
  Al  Al76  1  0.80741800  0.82832800  0.06477300  1
  Al  Al77  1  0.69258200  0.67167200  0.93522700  1
  Al  Al78  1  0.69258200  0.67167200  0.56477300  1
  Al  Al79  1  0.19258200  0.82832800  0.43522700  1
  Al  Al80  1  0.80741800  0.82832800  0.43522700  1
  Al  Al81  1  0.30741800  0.67167200  0.56477300  1
  Al  Al82  1  0.30741800  0.67167200  0.93522700  1
  Al  Al83  1  0.19258200  0.82832800  0.06477300  1
  Al  Al84  1  0.50000000  0.68569800  0.25000000  1
  Al  Al85  1  0.00000000  0.81430200  0.75000000  1
  Al  Al86  1  0.50000000  0.30166100  0.25000000  1
  Al  Al87  1  0.00000000  0.19833900  0.75000000  1
  Al  Al88  1  0.31583400  0.21784800  0.12648700  1
  Al  Al89  1  0.18416600  0.28215200  0.87351300  1
  Al  Al90  1  0.18416600  0.28215200  0.62648700  1
  Al  Al91  1  0.68416600  0.21784800  0.37351300  1
  Al  Al92  1  0.31583400  0.21784800  0.37351300  1
  Al  Al93  1  0.81583400  0.28215200  0.62648700  1
  Al  Al94  1  0.81583400  0.28215200  0.87351300  1
  Al  Al95  1  0.68416600  0.21784800  0.12648700  1
  Al  Al96  1  0.19372200  0.44646200  0.06844900  1
  Al  Al97  1  0.30627800  0.05353800  0.93155100  1
  Al  Al98  1  0.30627800  0.05353800  0.56844900  1
  Al  Al99  1  0.80627800  0.44646200  0.43155100  1
  Al  Al100  1  0.19372200  0.44646200  0.43155100  1
  Al  Al101  1  0.69372200  0.05353800  0.56844900  1
  Al  Al102  1  0.69372200  0.05353800  0.93155100  1
  Al  Al103  1  0.80627800  0.44646200  0.06844900  1
  Al  Al104  1  0.00000000  0.01561400  0.09400700  1
  Al  Al105  1  0.50000000  0.48438600  0.90599300  1
  Al  Al106  1  0.50000000  0.48438600  0.59400700  1
  Al  Al107  1  0.00000000  0.01561400  0.40599300  1
  Al  Al108  1  0.00000000  0.25841700  0.05496800  1
  Al  Al109  1  0.50000000  0.24158300  0.94503200  1
  Al  Al110  1  0.50000000  0.24158300  0.55496800  1
  Al  Al111  1  0.00000000  0.25841700  0.44503200  1
  Al  Al112  1  0.23934000  0.01639600  0.25000000  1
  Al  Al113  1  0.26066000  0.48360400  0.75000000  1
  Al  Al114  1  0.76066000  0.01639600  0.25000000  1
  Al  Al115  1  0.73934000  0.48360400  0.75000000  1
  Al  Al116  1  0.19107600  0.10967400  0.10625700  1
  Al  Al117  1  0.30892400  0.39032600  0.89374300  1
  Al  Al118  1  0.30892400  0.39032600  0.60625700  1
  Al  Al119  1  0.80892400  0.10967400  0.39374300  1
  Al  Al120  1  0.19107600  0.10967400  0.39374300  1
  Al  Al121  1  0.69107600  0.39032600  0.60625700  1
  Al  Al122  1  0.69107600  0.39032600  0.89374300  1
  Al  Al123  1  0.80892400  0.10967400  0.10625700  1
  Al  Al124  1  0.32650500  0.40365100  0.25000000  1
  Al  Al125  1  0.17349500  0.09634900  0.75000000  1
  Al  Al126  1  0.67349500  0.40365100  0.25000000  1
  Al  Al127  1  0.82650500  0.09634900  0.75000000  1
  Al  Al128  1  0.50000000  0.13629300  0.25000000  1
  Al  Al129  1  0.00000000  0.36370700  0.75000000  1
  Al  Al130  1  0.50000000  0.03961100  0.11139100  1
  Al  Al131  1  0.00000000  0.46038900  0.88860900  1
  Al  Al132  1  0.00000000  0.46038900  0.61139100  1
  Al  Al133  1  0.50000000  0.03961100  0.38860900  1
  Al  Al134  1  0.00000000  0.36442900  0.14904700  1
  Al  Al135  1  0.50000000  0.13557100  0.85095300  1
  Al  Al136  1  0.50000000  0.13557100  0.64904700  1
  Al  Al137  1  0.00000000  0.36442900  0.35095300  1
  Al  Al138  1  0.30741800  0.32832800  0.06477300  1
  Al  Al139  1  0.19258200  0.17167200  0.93522700  1
  Al  Al140  1  0.19258200  0.17167200  0.56477300  1
  Al  Al141  1  0.69258200  0.32832800  0.43522700  1
  Al  Al142  1  0.30741800  0.32832800  0.43522700  1
  Al  Al143  1  0.80741800  0.17167200  0.56477300  1
  Al  Al144  1  0.80741800  0.17167200  0.93522700  1
  Al  Al145  1  0.69258200  0.32832800  0.06477300  1
  Al  Al146  1  0.00000000  0.18569800  0.25000000  1
  Al  Al147  1  0.50000000  0.31430200  0.75000000  1
  Cu  Cu148  1  0.67234500  0.78512500  0.25000000  1
  Cu  Cu149  1  0.82765500  0.71487500  0.75000000  1
  Cu  Cu150  1  0.32765500  0.78512500  0.25000000  1
  Cu  Cu151  1  0.17234500  0.71487500  0.75000000  1
  Cu  Cu152  1  0.17234500  0.28512500  0.25000000  1
  Cu  Cu153  1  0.32765500  0.21487500  0.75000000  1
  Cu  Cu154  1  0.82765500  0.28512500  0.25000000  1
  Cu  Cu155  1  0.67234500  0.21487500  0.75000000  1
