# generated using pymatgen
data_Li10Sc9Fe(SiO3)20
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.87483175
_cell_length_b   9.03944602
_cell_length_c   11.16291480
_cell_angle_alpha   113.88406820
_cell_angle_beta   74.96743886
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li10Sc9Fe(SiO3)20
_chemical_formula_sum   'Li10 Sc9 Fe1 Si20 O60'
_cell_volume   1139.11120401
_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  0.95000000  0.20252578  0.90000000  1
  Li  Li1  1  0.85002095  0.59740137  0.69993542  1
  Li  Li2  1  0.74986425  0.00281883  0.50011954  1
  Li  Li3  1  0.64972419  0.39747271  0.29984315  1
  Li  Li4  1  0.54905589  0.80117321  0.09907732  1
  Li  Li5  1  0.45000000  0.19958487  0.90000000  1
  Li  Li6  1  0.35094411  0.60209589  0.70092268  1
  Li  Li7  1  0.25027581  0.99762956  0.50015685  1
  Li  Li8  1  0.15013575  0.40269929  0.29988046  1
  Li  Li9  1  0.04997905  0.79746595  0.10006458  1
  Sc  Sc10  1  0.95000000  0.84306045  0.90000000  1
  Sc  Sc11  1  0.84943149  0.95746682  0.70038365  1
  Sc  Sc12  1  0.74976027  0.64294864  0.50030262  1
  Sc  Sc13  1  0.64993622  0.75677583  0.29994607  1
  Sc  Sc14  1  0.54939985  0.44363679  0.09834625  1
  Sc  Sc15  1  0.35060015  0.24529054  0.70165375  1
  Sc  Sc16  1  0.25006378  0.35682976  0.50005393  1
  Sc  Sc17  1  0.15023973  0.04264602  0.29969738  1
  Sc  Sc18  1  0.05056851  0.15708316  0.09961635  1
  Fe  Fe19  1  0.45000000  0.55913477  0.90000000  1
  Si  Si20  1  0.98306892  0.77210037  0.37008951  1
  Si  Si21  1  0.91693108  0.30201086  0.42991049  1
  Si  Si22  1  0.88312440  0.49784122  0.16999390  1
  Si  Si23  1  0.81690642  0.02797288  0.22993244  1
  Si  Si24  1  0.71620507  0.10124025  0.02973751  1
  Si  Si25  1  0.78307947  0.57205328  0.96999816  1
  Si  Si26  1  0.68215632  0.29920338  0.77023026  1
  Si  Si27  1  0.61513962  0.82542077  0.83019550  1
  Si  Si28  1  0.58265320  0.37408534  0.57240356  1
  Si  Si29  1  0.51673703  0.90192071  0.63001407  1
  Si  Si30  1  0.48288018  0.09843343  0.37059218  1
  Si  Si31  1  0.41711982  0.62784125  0.42940782  1
  Si  Si32  1  0.38326297  0.17190765  0.16998593  1
  Si  Si33  1  0.31734680  0.70168077  0.22759644  1
  Si  Si34  1  0.21784368  0.42897411  0.02976974  1
  Si  Si35  1  0.28486038  0.89522527  0.96980450  1
  Si  Si36  1  0.18379493  0.97150273  0.77026249  1
  Si  Si37  1  0.11692053  0.50205512  0.83000184  1
  Si  Si38  1  0.08309358  0.69804044  0.57006756  1
  Si  Si39  1  0.01687560  0.22784831  0.63000610  1
  O  O40  1  0.97142171  0.61250936  0.23575065  1
  O  O41  1  0.93491774  0.97036726  0.11146954  1
  O  O42  1  0.92838334  0.30794868  0.11336103  1
  O  O43  1  0.97161666  0.09458765  0.68663897  1
  O  O44  1  0.96508226  0.75889772  0.68853046  1
  O  O45  1  0.92857829  0.27675871  0.56424935  1
  O  O46  1  0.87145658  0.52318332  0.03565878  1
  O  O47  1  0.87181477  0.49187684  0.48644278  1
  O  O48  1  0.86506972  0.82973626  0.48879507  1
  O  O49  1  0.82853635  0.18754253  0.36418315  1
  O  O50  1  0.77170204  0.89468327  0.28656253  1
  O  O51  1  0.83440825  0.04107997  0.91154343  1
  O  O52  1  0.76515945  0.55867963  0.28850332  1
  O  O53  1  0.82817780  0.70520154  0.91334711  1
  O  O54  1  0.72841172  0.07699035  0.16432444  1
  O  O55  1  0.77089724  0.41259675  0.83605512  1
  O  O56  1  0.67076793  0.29107038  0.08543093  1
  O  O57  1  0.73348197  0.76847087  0.71231776  1
  O  O58  1  0.66506507  0.62989647  0.08851470  1
  O  O59  1  0.72739621  0.10942640  0.71474034  1
  O  O60  1  0.67228134  0.32285823  0.63489021  1
  O  O61  1  0.63473820  0.84118249  0.51165308  1
  O  O62  1  0.62772191  0.50580274  0.51412261  1
  O  O63  1  0.62831029  0.98417335  0.96440133  1
  O  O64  1  0.56977885  0.21461873  0.43861269  1
  O  O65  1  0.53497911  0.57021913  0.31060741  1
  O  O66  1  0.52816670  0.90841251  0.31346989  1
  O  O67  1  0.56815715  0.69185739  0.88668294  1
  O  O68  1  0.56325670  0.36261230  0.88766455  1
  O  O69  1  0.52782673  0.87631102  0.76439571  1
  O  O70  1  0.47154792  0.12356613  0.23607338  1
  O  O71  1  0.43416686  0.63945486  0.10547989  1
  O  O72  1  0.42829066  0.30526080  0.11322117  1
  O  O73  1  0.47170934  0.09203963  0.68677883  1
  O  O74  1  0.46583314  0.43397498  0.69452011  1
  O  O75  1  0.42845208  0.78749275  0.56392662  1
  O  O76  1  0.37217327  0.01191531  0.03560429  1
  O  O77  1  0.37183330  0.49494162  0.48653011  1
  O  O78  1  0.36502089  0.15961172  0.48939259  1
  O  O79  1  0.33022115  0.67600604  0.36138731  1
  O  O80  1  0.27227809  0.89168013  0.28587739  1
  O  O81  1  0.33674330  0.37494675  0.91233545  1
  O  O82  1  0.26526180  0.22952942  0.28834692  1
  O  O83  1  0.33184285  0.70517444  0.91331706  1
  O  O84  1  0.22771866  0.58796802  0.16510979  1
  O  O85  1  0.27168971  0.91977202  0.83559867  1
  O  O86  1  0.17260379  0.29468606  0.08525966  1
  O  O87  1  0.23493493  0.44138177  0.71148530  1
  O  O88  1  0.16651803  0.95615311  0.08768224  1
  O  O89  1  0.22923207  0.10563945  0.71456907  1
  O  O90  1  0.17158828  0.81266591  0.63567556  1
  O  O91  1  0.13484055  0.17017531  0.51149668  1
  O  O92  1  0.12829796  0.50811974  0.51343747  1
  O  O93  1  0.12910276  0.47654063  0.96394488  1
  O  O94  1  0.07146365  0.72336038  0.43581685  1
  O  O95  1  0.03493028  0.24094119  0.31120493  1
  O  O96  1  0.02818523  0.90543406  0.31355722  1
  O  O97  1  0.07182220  0.69185543  0.88665289  1
  O  O98  1  0.06559175  0.02953654  0.88845657  1
  O  O99  1  0.02854342  0.38752354  0.76434122  1
