# generated using pymatgen
data_Li95Mn16O64
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.41891251
_cell_length_b   13.44009163
_cell_length_c   9.44544992
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00001059
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li95Mn16O64
_chemical_formula_sum   'Li95 Mn16 O64'
_cell_volume   1703.50024619
_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
  Li  Li0  1  0.62500000  0.12500000  0.10621904  1
  Li  Li1  1  0.12500100  0.62500100  0.10838459  1
  Li  Li2  1  0.62500000  0.62500100  0.10914730  1
  Li  Li3  1  0.48081766  0.01649914  0.12340656  1
  Li  Li4  1  0.48081766  0.23350086  0.12340656  1
  Li  Li5  1  0.76918134  0.01649914  0.12340656  1
  Li  Li6  1  0.76918134  0.23350086  0.12340656  1
  Li  Li7  1  0.26678478  0.51711668  0.12474860  1
  Li  Li8  1  0.26678478  0.73288332  0.12474860  1
  Li  Li9  1  0.98321422  0.51711668  0.12474860  1
  Li  Li10  1  0.98321422  0.73288332  0.12474860  1
  Li  Li11  1  0.48228030  0.51591951  0.12513772  1
  Li  Li12  1  0.48228030  0.73408049  0.12513772  1
  Li  Li13  1  0.76771870  0.51591951  0.12513772  1
  Li  Li14  1  0.76771870  0.73408049  0.12513772  1
  Li  Li15  1  0.25311417  0.02489098  0.12845753  1
  Li  Li16  1  0.25311417  0.22511002  0.12845753  1
  Li  Li17  1  0.99688483  0.02489098  0.12845753  1
  Li  Li18  1  0.99688483  0.22511002  0.12845753  1
  Li  Li19  1  0.37124069  0.37262364  0.14153220  1
  Li  Li20  1  0.37124069  0.87737736  0.14153220  1
  Li  Li21  1  0.87876131  0.37262364  0.14153220  1
  Li  Li22  1  0.87876131  0.87737736  0.14153220  1
  Li  Li23  1  0.12500100  0.12500100  0.34181414  1
  Li  Li24  1  0.62500000  0.12500100  0.35715944  1
  Li  Li25  1  0.12500100  0.62500100  0.35860226  1
  Li  Li26  1  0.62500000  0.62500100  0.35873294  1
  Li  Li27  1  0.51645969  0.26632202  0.37359280  1
  Li  Li28  1  0.51645969  0.98367698  0.37359280  1
  Li  Li29  1  0.73354031  0.26632202  0.37359280  1
  Li  Li30  1  0.73354031  0.98367698  0.37359280  1
  Li  Li31  1  0.51619499  0.48299478  0.37504216  1
  Li  Li32  1  0.51619499  0.76700422  0.37504216  1
  Li  Li33  1  0.73380501  0.48299478  0.37504216  1
  Li  Li34  1  0.73380501  0.76700422  0.37504216  1
  Li  Li35  1  0.01704633  0.48262261  0.37515023  1
  Li  Li36  1  0.01704633  0.76737739  0.37515023  1
  Li  Li37  1  0.23295367  0.48262261  0.37515023  1
  Li  Li38  1  0.23295367  0.76737739  0.37515023  1
  Li  Li39  1  0.01781505  0.26752799  0.37741135  1
  Li  Li40  1  0.01781505  0.98247201  0.37741135  1
  Li  Li41  1  0.23218495  0.26752799  0.37741135  1
  Li  Li42  1  0.23218495  0.98247201  0.37741135  1
  Li  Li43  1  0.37449612  0.37414631  0.39158951  1
  Li  Li44  1  0.37449612  0.87585469  0.39158951  1
  Li  Li45  1  0.87550588  0.37414631  0.39158951  1
  Li  Li46  1  0.87550588  0.87585469  0.39158951  1
  Li  Li47  1  0.12500100  0.12500000  0.60659014  1
  Li  Li48  1  0.62500000  0.12500000  0.60686658  1
  Li  Li49  1  0.12500100  0.62500100  0.60797773  1
  Li  Li50  1  0.62500000  0.62500100  0.60838201  1
  Li  Li51  1  0.48426358  0.01633445  0.62373873  1
  Li  Li52  1  0.48426358  0.23366555  0.62373873  1
  Li  Li53  1  0.76573542  0.01633445  0.62373873  1
  Li  Li54  1  0.76573542  0.23366555  0.62373873  1
  Li  Li55  1  0.26687274  0.51672098  0.62510011  1
  Li  Li56  1  0.26687274  0.73327902  0.62510011  1
  Li  Li57  1  0.98312726  0.51672098  0.62510011  1
  Li  Li58  1  0.98312726  0.73327902  0.62510011  1
  Li  Li59  1  0.48280854  0.51723272  0.62533659  1
  Li  Li60  1  0.48280854  0.73276728  0.62533659  1
  Li  Li61  1  0.76719146  0.51723272  0.62533659  1
  Li  Li62  1  0.76719146  0.73276728  0.62533659  1
  Li  Li63  1  0.26553678  0.01725293  0.62611235  1
  Li  Li64  1  0.26553678  0.23274707  0.62611235  1
  Li  Li65  1  0.98446322  0.01725293  0.62611235  1
  Li  Li66  1  0.98446322  0.23274707  0.62611235  1
  Li  Li67  1  0.37506458  0.37499787  0.64275775  1
  Li  Li68  1  0.37506458  0.87500413  0.64275775  1
  Li  Li69  1  0.87493642  0.37499787  0.64275775  1
  Li  Li70  1  0.87493642  0.87500413  0.64275775  1
  Li  Li71  1  0.62500000  0.12500100  0.85479698  1
  Li  Li72  1  0.12500100  0.62500100  0.85794102  1
  Li  Li73  1  0.62500000  0.62500100  0.85884508  1
  Li  Li74  1  0.12500100  0.12500100  0.86806597  1
  Li  Li75  1  0.51801684  0.26870825  0.87456685  1
  Li  Li76  1  0.51801684  0.98129175  0.87456685  1
  Li  Li77  1  0.73198416  0.26870825  0.87456685  1
  Li  Li78  1  0.73198416  0.98129175  0.87456685  1
  Li  Li79  1  0.01752397  0.48360702  0.87496459  1
  Li  Li80  1  0.01752397  0.76639298  0.87496459  1
  Li  Li81  1  0.23247703  0.48360702  0.87496459  1
  Li  Li82  1  0.23247703  0.76639298  0.87496459  1
  Li  Li83  1  0.51663987  0.48349584  0.87555225  1
  Li  Li84  1  0.51663987  0.76650516  0.87555225  1
  Li  Li85  1  0.73336113  0.48349584  0.87555225  1
  Li  Li86  1  0.73336113  0.76650516  0.87555225  1
  Li  Li87  1  0.01710794  0.26689375  0.87627376  1
  Li  Li88  1  0.01710794  0.98310625  0.87627376  1
  Li  Li89  1  0.23289206  0.26689375  0.87627376  1
  Li  Li90  1  0.23289206  0.98310625  0.87627376  1
  Li  Li91  1  0.37445570  0.37587372  0.89352458  1
  Li  Li92  1  0.37445570  0.87412828  0.89352458  1
  Li  Li93  1  0.87554630  0.37587372  0.89352458  1
  Li  Li94  1  0.87554630  0.87412828  0.89352458  1
  Mn  Mn95  1  0.12500100  0.37694200  0.12551732  1
  Mn  Mn96  1  0.12500100  0.87305900  0.12551732  1
  Mn  Mn97  1  0.62500000  0.37509486  0.12569388  1
  Mn  Mn98  1  0.62500000  0.87490714  0.12569388  1
  Mn  Mn99  1  0.37462785  0.62500100  0.37410700  1
  Mn  Mn100  1  0.87537415  0.62500100  0.37410700  1
  Mn  Mn101  1  0.37415305  0.12500000  0.37502408  1
  Mn  Mn102  1  0.87584795  0.12500000  0.37502408  1
  Mn  Mn103  1  0.62500000  0.37592190  0.62398439  1
  Mn  Mn104  1  0.62500000  0.87407910  0.62398439  1
  Mn  Mn105  1  0.12500100  0.37512609  0.62621588  1
  Mn  Mn106  1  0.12500100  0.87487491  0.62621588  1
  Mn  Mn107  1  0.37682771  0.12500000  0.87220427  1
  Mn  Mn108  1  0.87317329  0.12500000  0.87220427  1
  Mn  Mn109  1  0.37497514  0.62500100  0.87489229  1
  Mn  Mn110  1  0.87502586  0.62500100  0.87489229  1
  O  O111  1  0.25685934  0.37641242  0.01110083  1
  O  O112  1  0.25685934  0.87358958  0.01110083  1
  O  O113  1  0.99314166  0.37641242  0.01110083  1
  O  O114  1  0.99314166  0.87358958  0.01110083  1
  O  O115  1  0.49173398  0.37473345  0.01364899  1
  O  O116  1  0.49173398  0.87526755  0.01364899  1
  O  O117  1  0.75826702  0.37473345  0.01364899  1
  O  O118  1  0.75826702  0.87526755  0.01364899  1
  O  O119  1  0.62500000  0.00881235  0.23542846  1
  O  O120  1  0.62500000  0.24118765  0.23542846  1
  O  O121  1  0.12500100  0.50923785  0.23741719  1
  O  O122  1  0.12500100  0.74076115  0.23741719  1
  O  O123  1  0.62500000  0.50762850  0.23774218  1
  O  O124  1  0.62500000  0.74237150  0.23774218  1
  O  O125  1  0.12500100  0.00073310  0.24313702  1
  O  O126  1  0.12500100  0.24926690  0.24313702  1
  O  O127  1  0.87687163  0.25654783  0.26239500  1
  O  O128  1  0.87687163  0.99345317  0.26239500  1
  O  O129  1  0.37313037  0.25654783  0.26239600  1
  O  O130  1  0.37313037  0.99345317  0.26239600  1
  O  O131  1  0.37457177  0.49121271  0.26341023  1
  O  O132  1  0.37457177  0.75878829  0.26341023  1
  O  O133  1  0.87543023  0.49121271  0.26341023  1
  O  O134  1  0.87543023  0.75878829  0.26341023  1
  O  O135  1  0.00777017  0.12500100  0.48680545  1
  O  O136  1  0.24223083  0.12500000  0.48680545  1
  O  O137  1  0.50789739  0.12500100  0.48644833  1
  O  O138  1  0.74210261  0.12500000  0.48644833  1
  O  O139  1  0.50762349  0.62500100  0.48714863  1
  O  O140  1  0.74237551  0.62500100  0.48714863  1
  O  O141  1  0.00769450  0.62500100  0.48740291  1
  O  O142  1  0.24230550  0.62500100  0.48740291  1
  O  O143  1  0.49172923  0.37389061  0.51320264  1
  O  O144  1  0.49172923  0.87611139  0.51320264  1
  O  O145  1  0.75827177  0.37389061  0.51320264  1
  O  O146  1  0.75827177  0.87611139  0.51320264  1
  O  O147  1  0.25874401  0.37501381  0.51568155  1
  O  O148  1  0.25874401  0.87498819  0.51568155  1
  O  O149  1  0.99125599  0.37501381  0.51568255  1
  O  O150  1  0.99125599  0.87498819  0.51568255  1
  O  O151  1  0.62500000  0.00771479  0.73564760  1
  O  O152  1  0.62500000  0.24228621  0.73564760  1
  O  O153  1  0.12500100  0.50843480  0.73645482  1
  O  O154  1  0.12500100  0.74156620  0.73645482  1
  O  O155  1  0.62500000  0.50794635  0.73710291  1
  O  O156  1  0.62500000  0.74205365  0.73710291  1
  O  O157  1  0.12500100  0.00802328  0.73746927  1
  O  O158  1  0.12500100  0.24197672  0.73746927  1
  O  O159  1  0.37554920  0.49168075  0.76346327  1
  O  O160  1  0.37554920  0.75832025  0.76346327  1
  O  O161  1  0.87445180  0.49168075  0.76346327  1
  O  O162  1  0.87445180  0.75832025  0.76346327  1
  O  O163  1  0.37642501  0.25640914  0.76656686  1
  O  O164  1  0.37642501  0.99359186  0.76656686  1
  O  O165  1  0.87357699  0.25640914  0.76656686  1
  O  O166  1  0.87357699  0.99359186  0.76656686  1
  O  O167  1  0.00034642  0.12500100  0.97306975  1
  O  O168  1  0.24965458  0.12500000  0.97306975  1
  O  O169  1  0.50785531  0.12500100  0.98190168  1
  O  O170  1  0.74214469  0.12500000  0.98190168  1
  O  O171  1  0.00803337  0.62500100  0.98652422  1
  O  O172  1  0.24196663  0.62500100  0.98652422  1
  O  O173  1  0.50778862  0.62500100  0.98739473  1
  O  O174  1  0.74221238  0.62500100  0.98739473  1
