# generated using pymatgen
data_Li22(Cu3Si2)7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.57267111
_cell_length_b   14.02824138
_cell_length_c   14.02824138
_cell_angle_alpha   119.99999865
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li22(Cu3Si2)7
_chemical_formula_sum   'Li66 Cu63 Si42'
_cell_volume   2313.14268806
_cell_formula_units_Z   3
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  0.18710481  0.85076365  0.96028733  1
  Li  Li1  1  0.85377181  0.10952368  0.14923635  1
  Li  Li2  1  0.52043781  0.03971267  0.89047632  1
  Li  Li3  1  0.25662767  0.51632403  0.62643766  1
  Li  Li4  1  0.92329467  0.11011363  0.48367597  1
  Li  Li5  1  0.58996067  0.37356234  0.88988637  1
  Li  Li6  1  0.10805732  0.70259071  0.73833530  1
  Li  Li7  1  0.77472432  0.03574459  0.29740929  1
  Li  Li8  1  0.44139032  0.26166470  0.96425541  1
  Li  Li9  1  0.37430551  0.91513144  0.96170396  1
  Li  Li10  1  0.04097251  0.04657252  0.08486856  1
  Li  Li11  1  0.70763851  0.03829604  0.95342748  1
  Li  Li12  1  0.82474830  0.59598948  0.07512354  1
  Li  Li13  1  0.49141530  0.47913406  0.40401052  1
  Li  Li14  1  0.15808130  0.92487646  0.52086594  1
  Li  Li15  1  0.83002379  0.25247975  0.40265830  1
  Li  Li16  1  0.49669079  0.15017855  0.74752025  1
  Li  Li17  1  0.16335679  0.59734170  0.84982145  1
  Li  Li18  1  0.10450899  0.92458181  0.18732765  1
  Li  Li19  1  0.77117599  0.26274583  0.07541819  1
  Li  Li20  1  0.43784199  0.81267235  0.73725417  1
  Li  Li21  1  0.50404272  0.84202096  0.07759498  1
  Li  Li22  1  0.17070972  0.23557402  0.15797904  1
  Li  Li23  1  0.83737572  0.92240502  0.76442598  1
  Li  Li24  1  0.89174309  0.38294413  0.62917317  1
  Li  Li25  1  0.55841009  0.24622905  0.61705587  1
  Li  Li26  1  0.22507609  0.37082683  0.75377095  1
  Li  Li27  1  0.76273831  0.56745248  0.73916402  1
  Li  Li28  1  0.42940531  0.17171154  0.43254752  1
  Li  Li29  1  0.09607131  0.26083598  0.82828846  1
  Li  Li30  1  0.49155769  0.91955452  0.62997810  1
  Li  Li31  1  0.15822469  0.71042358  0.08044548  1
  Li  Li32  1  0.82489069  0.37002190  0.28957642  1
  Li  Li33  1  0.44061980  0.91991844  0.30073162  1
  Li  Li34  1  0.10728680  0.38081318  0.08008156  1
  Li  Li35  1  0.77395280  0.69926838  0.61918682  1
  Li  Li36  1  0.76182262  0.90283688  0.41518451  1
  Li  Li37  1  0.42848962  0.51234763  0.09716312  1
  Li  Li38  1  0.09515562  0.58481549  0.48765237  1
  Li  Li39  1  0.43711981  0.57094072  0.62375538  1
  Li  Li40  1  0.10378681  0.05281466  0.42905928  1
  Li  Li41  1  0.77045281  0.37624462  0.94718534  1
  Li  Li42  1  0.82601845  0.71812254  0.96052009  1
  Li  Li43  1  0.49268545  0.24239754  0.28187746  1
  Li  Li44  1  0.15935145  0.03947991  0.75760246  1
  Li  Li45  1  0.70354495  0.90633869  0.07249337  1
  Li  Li46  1  0.37021195  0.16615468  0.09366131  1
  Li  Li47  1  0.03687795  0.92750663  0.83384532  1
  Li  Li48  1  0.56241404  0.83621772  0.40845663  1
  Li  Li49  1  0.22908104  0.57223891  0.16378228  1
  Li  Li50  1  0.89574704  0.59154337  0.42776109  1
  Li  Li51  1  0.49012428  0.60506285  0.96910442  1
  Li  Li52  1  0.15679128  0.36404157  0.39493715  1
  Li  Li53  1  0.82345728  0.03089558  0.63595843  1
  Li  Li54  1  0.56178116  0.49989056  0.73699383  1
  Li  Li55  1  0.22844816  0.23710327  0.50010944  1
  Li  Li56  1  0.89511416  0.26300617  0.76289673  1
  Li  Li57  1  0.74285748  0.18195959  0.56032719  1
  Li  Li58  1  0.40952448  0.37836759  0.81804041  1
  Li  Li59  1  0.07619048  0.43967281  0.62163241  1
  Li  Li60  1  0.89178944  0.72162867  0.30343612  1
  Li  Li61  1  0.55845644  0.58180746  0.27837133  1
  Li  Li62  1  0.22512244  0.69656388  0.41819254  1
  Li  Li63  1  0.74589955  0.51806545  0.22053543  1
  Li  Li64  1  0.41256655  0.70246999  0.48193455  1
  Li  Li65  1  0.07923255  0.77946457  0.29753001  1
  Cu  Cu66  1  0.94672774  0.92516745  0.30686967  1
  Cu  Cu67  1  0.61339474  0.38170222  0.07483255  1
  Cu  Cu68  1  0.28006074  0.69313033  0.61829778  1
  Cu  Cu69  1  0.74537517  0.81453627  0.85504492  1
  Cu  Cu70  1  0.41204217  0.04050864  0.18546373  1
  Cu  Cu71  1  0.07870817  0.14495508  0.95949136  1
  Cu  Cu72  1  0.85612503  0.47719844  0.84645401  1
  Cu  Cu73  1  0.52279203  0.36925557  0.52280156  1
  Cu  Cu74  1  0.18945803  0.15354599  0.63074443  1
  Cu  Cu75  1  0.80452743  0.47153263  0.51100632  1
  Cu  Cu76  1  0.47119443  0.03947369  0.52846737  1
  Cu  Cu77  1  0.13786043  0.48899368  0.96052631  1
  Cu  Cu78  1  0.65522038  0.71614958  0.07184580  1
  Cu  Cu79  1  0.32188738  0.35569622  0.28385042  1
  Cu  Cu80  1  0.98855338  0.92815420  0.64430378  1
  Cu  Cu81  1  0.69931095  0.36367929  0.57536790  1
  Cu  Cu82  1  0.36597795  0.21168861  0.63632071  1
  Cu  Cu83  1  0.03264395  0.42463210  0.78831139  1
  Cu  Cu84  1  0.57327975  0.87428675  0.91168220  1
  Cu  Cu85  1  0.23994675  0.03739545  0.12571325  1
  Cu  Cu86  1  0.90661275  0.08831780  0.96260455  1
  Cu  Cu87  1  0.99258824  0.60884550  0.96423673  1
  Cu  Cu88  1  0.65925524  0.35539123  0.39115450  1
  Cu  Cu89  1  0.32592124  0.03576327  0.64460877  1
  Cu  Cu90  1  0.95022552  0.58386950  0.62310764  1
  Cu  Cu91  1  0.61689252  0.03923814  0.41613050  1
  Cu  Cu92  1  0.28355852  0.37689236  0.96076186  1
  Cu  Cu93  1  0.35004386  0.86924917  0.45842009  1
  Cu  Cu94  1  0.01671086  0.58917092  0.13075083  1
  Cu  Cu95  1  0.68337686  0.54157991  0.41082908  1
  Cu  Cu96  1  0.69189858  0.70655449  0.24737502  1
  Cu  Cu97  1  0.35856558  0.54082054  0.29344551  1
  Cu  Cu98  1  0.02523158  0.75262498  0.45917946  1
  Cu  Cu99  1  0.92251366  0.75762265  0.79923221  1
  Cu  Cu100  1  0.58918066  0.04160955  0.24237735  1
  Cu  Cu101  1  0.25584666  0.20076779  0.95839045  1
  Cu  Cu102  1  0.46619590  0.70653687  0.84805517  1
  Cu  Cu103  1  0.13286290  0.14151831  0.29346313  1
  Cu  Cu104  1  0.79952890  0.15194483  0.85848169  1
  Cu  Cu105  1  0.98631021  0.24812426  0.28197575  1
  Cu  Cu106  1  0.65297721  0.03385149  0.75187574  1
  Cu  Cu107  1  0.31964321  0.71802425  0.96614851  1
  Cu  Cu108  1  0.52098601  0.71352079  0.19434881  1
  Cu  Cu109  1  0.18765301  0.48082802  0.28647921  1
  Cu  Cu110  1  0.85431901  0.80565119  0.51917198  1
  Cu  Cu111  1  0.67980718  0.53873516  0.90568812  1
  Cu  Cu112  1  0.34647418  0.36695296  0.46126484  1
  Cu  Cu113  1  0.01314018  0.09431188  0.63304704  1
  Cu  Cu114  1  0.79812635  0.81893787  0.19120958  1
  Cu  Cu115  1  0.46479335  0.37227171  0.18106213  1
  Cu  Cu116  1  0.13145935  0.80879042  0.62772829  1
  Cu  Cu117  1  0.35210307  0.53831935  0.79423782  1
  Cu  Cu118  1  0.01877007  0.25591847  0.46168065  1
  Cu  Cu119  1  0.68543607  0.20576218  0.74408153  1
  Cu  Cu120  1  0.67820986  0.86533287  0.57545451  1
  Cu  Cu121  1  0.34487686  0.71012164  0.13466713  1
  Cu  Cu122  1  0.01154286  0.42454549  0.28987836  1
  Cu  Cu123  1  0.60992014  0.69238165  0.72515307  1
  Cu  Cu124  1  0.27658714  0.03277142  0.30761835  1
  Cu  Cu125  1  0.94325314  0.27484693  0.96722858  1
  Cu  Cu126  1  0.91577355  0.92016116  0.12457488  1
  Cu  Cu127  1  0.58244055  0.20441372  0.07983884  1
  Cu  Cu128  1  0.24910655  0.87542512  0.79558628  1
  Si  Si129  1  0.63267404  0.70305948  0.90158469  1
  Si  Si130  1  0.29934104  0.19852522  0.29694052  1
  Si  Si131  1  0.96600704  0.09841531  0.80147478  1
  Si  Si132  1  0.25485430  0.84748591  0.29729050  1
  Si  Si133  1  0.92152130  0.44980458  0.15251409  1
  Si  Si134  1  0.58818730  0.70270950  0.55019542  1
  Si  Si135  1  0.96030516  0.75807483  0.13691946  1
  Si  Si136  1  0.62697216  0.37884463  0.24192517  1
  Si  Si137  1  0.29363816  0.86308054  0.62115537  1
  Si  Si138  1  0.87967186  0.92258149  0.96159897  1
  Si  Si139  1  0.54633886  0.03901748  0.07741851  1
  Si  Si140  1  0.21300486  0.03840103  0.96098252  1
  Si  Si141  1  0.63168392  0.87459971  0.24482058  1
  Si  Si142  1  0.29835092  0.37022087  0.12540029  1
  Si  Si143  1  0.96501692  0.75517942  0.62977913  1
  Si  Si144  1  0.01227275  0.78489134  0.96362460  1
  Si  Si145  1  0.67893975  0.17873326  0.21510866  1
  Si  Si146  1  0.34560575  0.03637540  0.82126674  1
  Si  Si147  1  0.63567743  0.52486460  0.56871525  1
  Si  Si148  1  0.30234443  0.04385065  0.47513540  1
  Si  Si149  1  0.96901043  0.43128475  0.95614935  1
  Si  Si150  1  0.29999120  0.70624058  0.79285696  1
  Si  Si151  1  0.96665820  0.08661638  0.29375942  1
  Si  Si152  1  0.63332420  0.20714304  0.91338362  1
  Si  Si153  1  0.30687155  0.87871404  0.13129133  1
  Si  Si154  1  0.97353855  0.25257730  0.12128596  1
  Si  Si155  1  0.64020455  0.86870867  0.74742270  1
  Si  Si156  1  0.96584882  0.92136174  0.46918452  1
  Si  Si157  1  0.63251582  0.54782278  0.07863826  1
  Si  Si158  1  0.29918182  0.53081548  0.45217722  1
  Si  Si159  1  0.71354809  0.37067967  0.74468520  1
  Si  Si160  1  0.38021509  0.37400553  0.62932033  1
  Si  Si161  1  0.04688109  0.25531480  0.62599447  1
  Si  Si162  1  0.96395250  0.58381567  0.78865029  1
  Si  Si163  1  0.63061950  0.20483461  0.41618433  1
  Si  Si164  1  0.29728550  0.21134971  0.79516539  1
  Si  Si165  1  0.71751521  0.70449501  0.40925309  1
  Si  Si166  1  0.38418221  0.70475808  0.29550499  1
  Si  Si167  1  0.05084821  0.59074691  0.29524192  1
  Si  Si168  1  0.96961483  0.41885878  0.45616522  1
  Si  Si169  1  0.63628183  0.03730644  0.58114122  1
  Si  Si170  1  0.30294783  0.54383478  0.96269356  1
