data_[Na30Y6Ta18Si33S3O144]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Y  1.2200  1.8000  1.0400
  Ta  1.5000  1.4500  0.8200
  Si  1.9000  1.1000  0.5400
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [9.1073]
_cell_length_b [15.7743]
_cell_length_c [22.8455]
_cell_angle_alpha [89.8468]
_cell_angle_beta [89.9812]
_cell_angle_gamma [89.9936]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Na10Y2Ta6Si11SO48]
_chemical_formula_sum '[Na30 Y6 Ta18 Si33 S3 O144]'
_cell_volume [3282.0138]
_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
[
  Na  Na0  1  0.0003  0.9879  0.5043  1
  Na  Na1  1  0.0042  0.9917  0.0036  1
  Na  Na2  1  0.0058  0.6696  0.3333  1
  Na  Na3  1  0.0176  0.6619  0.8336  1
  Na  Na4  1  0.1275  0.1656  0.5843  1
  Na  Na5  1  0.1700  0.1804  0.2524  1
  Na  Na6  1  0.3063  0.9809  0.0863  1
  Na  Na7  1  0.3159  0.6586  0.4163  1
  Na  Na8  1  0.3214  0.3525  0.0822  1
  Na  Na9  1  0.3215  0.3204  0.7491  1
  Na  Na10  1  0.3319  0.0118  0.4159  1
  Na  Na11  1  0.3737  0.6638  0.0858  1
  Na  Na12  1  0.4888  0.8381  0.1726  1
  Na  Na13  1  0.4890  0.1631  0.8334  1
  Na  Na14  1  0.4937  0.4940  0.5054  1
  Na  Na15  1  0.4956  0.4970  0.9983  1
  Na  Na16  1  0.4972  0.8272  0.6695  1
  Na  Na17  1  0.5066  0.1686  0.3331  1
  Na  Na18  1  0.6701  0.0126  0.9146  1
  Na  Na19  1  0.6708  0.6821  0.2526  1
  Na  Na20  1  0.6834  0.6531  0.9140  1
  Na  Na21  1  0.6929  0.9810  0.5848  1
  Na  Na22  1  0.8013  0.8167  0.7493  1
  Na  Na23  1  0.8072  0.4847  0.0864  1
  Na  Na24  1  0.8154  0.1573  0.4161  1
  Na  Na25  1  0.8249  0.1824  0.7476  1
  Na  Na26  1  0.8321  0.5132  0.4161  1
  Na  Na27  1  0.8732  0.1621  0.0876  1
  Na  Na28  1  0.9781  0.3369  0.1752  1
  Na  Na29  1  0.9914  0.3432  0.6637  1
  Y  Y30  1  0.0032  0.0007  0.6446  1
  Y  Y31  1  0.4907  0.8368  0.3190  1
  Y  Y32  1  0.4984  0.8299  0.8172  1
  Y  Y33  1  0.5041  0.5019  0.1462  1
  Y  Y34  1  0.9915  0.3362  0.3187  1
  Y  Y35  1  0.9965  0.9959  0.1441  1
  Ta  Ta36  1  0.0000  0.6657  0.4840  1
  Ta  Ta37  1  0.0004  0.3389  0.8133  1
  Ta  Ta38  1  0.0005  0.0078  0.8568  1
  Ta  Ta39  1  0.0024  0.0057  0.3554  1
  Ta  Ta40  1  0.0042  0.6660  0.9785  1
  Ta  Ta41  1  0.0058  0.6614  0.1859  1
  Ta  Ta42  1  0.4943  0.1704  0.9763  1
  Ta  Ta43  1  0.4977  0.1710  0.4824  1
  Ta  Ta44  1  0.4983  0.5001  0.8542  1
  Ta  Ta45  1  0.4985  0.8302  0.5216  1
  Ta  Ta46  1  0.5014  0.4999  0.6451  1
  Ta  Ta47  1  0.5020  0.8328  0.0192  1
  Ta  Ta48  1  0.5020  0.1654  0.6876  1
  Ta  Ta49  1  0.5036  0.5066  0.3551  1
  Ta  Ta50  1  0.5070  0.1598  0.1860  1
  Ta  Ta51  1  0.9952  0.6586  0.6844  1
  Ta  Ta52  1  0.9995  0.3329  0.0188  1
  Ta  Ta53  1  0.9996  0.3376  0.5208  1
  Si  Si54  1  0.1376  0.5190  0.0813  1
  Si  Si55  1  0.1473  0.8074  0.0810  1
  Si  Si56  1  0.1498  0.1485  0.7500  1
  Si  Si57  1  0.1508  0.1892  0.4168  1
  Si  Si58  1  0.1515  0.4812  0.4187  1
  Si  Si59  1  0.2007  0.8327  0.4196  1
  Si  Si60  1  0.2150  0.5035  0.7497  1
  Si  Si61  1  0.2150  0.1709  0.0831  1
  Si  Si62  1  0.2885  0.3357  0.9160  1
  Si  Si63  1  0.2887  0.6665  0.5850  1
  Si  Si64  1  0.2978  0.0017  0.2471  1
  Si  Si65  1  0.3470  0.6486  0.2483  1
  Si  Si66  1  0.3509  0.9795  0.9180  1
  Si  Si67  1  0.3520  0.6836  0.9179  1
  Si  Si68  1  0.3540  0.3128  0.5855  1
  Si  Si69  1  0.3627  0.0203  0.5822  1
  Si  Si70  1  0.6380  0.0211  0.0779  1
  Si  Si71  1  0.6464  0.3582  0.7495  1
  Si  Si72  1  0.6469  0.6423  0.7485  1
  Si  Si73  1  0.6475  0.3066  0.0814  1
  Si  Si74  1  0.6494  0.9814  0.4205  1
  Si  Si75  1  0.6549  0.6888  0.4157  1
  Si  Si76  1  0.7018  0.3341  0.4186  1
  Si  Si77  1  0.7040  0.0007  0.7492  1
  Si  Si78  1  0.7162  0.6725  0.0818  1
  Si  Si79  1  0.7884  0.1726  0.5826  1
  Si  Si80  1  0.7984  0.8336  0.9161  1
  Si  Si81  1  0.8011  0.5022  0.2478  1
  Si  Si82  1  0.8495  0.1472  0.2475  1
  Si  Si83  1  0.8500  0.8081  0.5839  1
  Si  Si84  1  0.8512  0.5189  0.5821  1
  Si  Si85  1  0.8530  0.4784  0.9172  1
  Si  Si86  1  0.8530  0.1922  0.9154  1
  S  S87  1  0.1389  0.8518  0.7516  1
  S  S88  1  0.3598  0.3512  0.2507  1
  S  S89  1  0.8594  0.8507  0.2520  1
  O  O90  1  0.0533  0.4269  0.0765  1
  O  O91  1  0.0580  0.7679  0.7490  1
  O  O92  1  0.0587  0.4509  0.3635  1
  O  O93  1  0.0638  0.5657  0.1404  1
  O  O94  1  0.0661  0.2353  0.4726  1
  O  O95  1  0.0681  0.0928  0.4106  1
  O  O96  1  0.0701  0.1187  0.6909  1
  O  O97  1  0.0743  0.8975  0.8036  1
  O  O98  1  0.0786  0.2435  0.7632  1
  O  O99  1  0.0810  0.7553  0.0259  1
  O  O100  1  0.0865  0.9026  0.0798  1
  O  O101  1  0.0882  0.5776  0.4304  1
  O  O102  1  0.0938  0.7514  0.4328  1
  O  O103  1  0.0963  0.5796  0.0271  1
  O  O104  1  0.1063  0.9214  0.4089  1
  O  O105  1  0.1085  0.0837  0.8055  1
  O  O106  1  0.1095  0.5868  0.7414  1
  O  O107  1  0.1107  0.7465  0.1393  1
  O  O108  1  0.1112  0.0884  0.0813  1
  O  O109  1  0.1118  0.8999  0.6978  1
  O  O110  1  0.1126  0.4167  0.7587  1
  O  O111  1  0.1139  0.4173  0.4747  1
  O  O112  1  0.1145  0.2581  0.0758  1
  O  O113  1  0.1384  0.2366  0.3555  1
  O  O114  1  0.1651  0.6545  0.2449  1
  O  O115  1  0.1712  0.9889  0.9087  1
  O  O116  1  0.1737  0.3155  0.5763  1
  O  O117  1  0.1754  0.6792  0.6407  1
  O  O118  1  0.1777  0.6666  0.9291  1
  O  O119  1  0.1794  0.0125  0.3055  1
  O  O120  1  0.1811  0.3237  0.8591  1
  O  O121  1  0.1816  0.3465  0.9746  1
  O  O122  1  0.1861  0.6528  0.5268  1
  O  O123  1  0.1870  0.0188  0.5820  1
  O  O124  1  0.2021  0.3369  0.2558  1
  O  O125  1  0.2055  0.9945  0.1874  1
  O  O126  1  0.2912  0.8016  0.3635  1
  O  O127  1  0.2961  0.8387  0.7565  1
  O  O128  1  0.3128  0.5062  0.0818  1
  O  O129  1  0.3184  0.8520  0.4739  1
  O  O130  1  0.3189  0.1865  0.1421  1
  O  O131  1  0.3210  0.5145  0.8076  1
  O  O132  1  0.3215  0.4826  0.6939  1
  O  O133  1  0.3231  0.1654  0.4290  1
  O  O134  1  0.3279  0.1637  0.0280  1
  O  O135  1  0.3293  0.1610  0.7458  1
  O  O136  1  0.3295  0.8108  0.0761  1
  O  O137  1  0.3311  0.4919  0.4100  1
  O  O138  1  0.3635  0.7382  0.8600  1
  O  O139  1  0.3834  0.9182  0.9762  1
  O  O140  1  0.3841  0.0970  0.2448  1
  O  O141  1  0.3842  0.2512  0.6433  1
  O  O142  1  0.3856  0.3962  0.1946  1
  O  O143  1  0.3889  0.7523  0.5747  1
  O  O144  1  0.3907  0.5854  0.3069  1
  O  O145  1  0.3911  0.2508  0.9228  1
  O  O146  1  0.3924  0.4192  0.9085  1
  O  O147  1  0.3929  0.5826  0.5937  1
  O  O148  1  0.4046  0.0792  0.5258  1
  O  O149  1  0.4058  0.6063  0.1886  1
  O  O150  1  0.4123  0.9257  0.2518  1
  O  O151  1  0.4197  0.0751  0.9294  1
  O  O152  1  0.4217  0.3986  0.3014  1
  O  O153  1  0.4222  0.2628  0.5291  1
  O  O154  1  0.4282  0.4058  0.5911  1
  O  O155  1  0.4328  0.7372  0.2534  1
  O  O156  1  0.4331  0.7333  0.9746  1
  O  O157  1  0.4357  0.0715  0.6397  1
  O  O158  1  0.4357  0.2657  0.2485  1
  O  O159  1  0.4412  0.5918  0.9132  1
  O  O160  1  0.4438  0.9472  0.8634  1
  O  O161  1  0.4466  0.9284  0.5777  1
  O  O162  1  0.5510  0.9300  0.0753  1
  O  O163  1  0.5570  0.9511  0.3651  1
  O  O164  1  0.5620  0.0681  0.1377  1
  O  O165  1  0.5652  0.7374  0.4693  1
  O  O166  1  0.5664  0.4033  0.8062  1
  O  O167  1  0.5694  0.5928  0.4105  1
  O  O168  1  0.5696  0.2635  0.7419  1
  O  O169  1  0.5724  0.3992  0.0817  1
  O  O170  1  0.5796  0.5878  0.6936  1
  O  O171  1  0.5801  0.2581  0.0247  1
  O  O172  1  0.5830  0.7374  0.7472  1
  O  O173  1  0.5883  0.0795  0.4311  1
  O  O174  1  0.5934  0.2535  0.4305  1
  O  O175  1  0.5977  0.0816  0.0222  1
  O  O176  1  0.6020  0.9184  0.7537  1
  O  O177  1  0.6073  0.4223  0.4089  1
  O  O178  1  0.6103  0.4147  0.6917  1
  O  O179  1  0.6105  0.5888  0.0813  1
  O  O180  1  0.6113  0.7573  0.0753  1
  O  O181  1  0.6114  0.5856  0.8086  1
  O  O182  1  0.6130  0.0932  0.7458  1
  O  O183  1  0.6134  0.2458  0.1393  1
  O  O184  1  0.6149  0.9188  0.4774  1
  O  O185  1  0.6407  0.7356  0.3542  1
  O  O186  1  0.6667  0.1537  0.2441  1
  O  O187  1  0.6696  0.8140  0.5759  1
  O  O188  1  0.6740  0.5102  0.5897  1
  O  O189  1  0.6754  0.4883  0.9091  1
  O  O190  1  0.6765  0.1743  0.9215  1
  O  O191  1  0.6772  0.8507  0.9702  1
  O  O192  1  0.6786  0.1631  0.5271  1
  O  O193  1  0.6799  0.5121  0.3053  1
  O  O194  1  0.6832  0.1820  0.6419  1
  O  O195  1  0.7019  0.8363  0.2575  1
  O  O196  1  0.7110  0.4923  0.1875  1
  O  O197  1  0.7139  0.8074  0.8572  1
  O  O198  1  0.7925  0.3023  0.3629  1
  O  O199  1  0.7999  0.9892  0.6906  1
  O  O200  1  0.8132  0.0172  0.0794  1
  O  O201  1  0.8194  0.6814  0.1416  1
  O  O202  1  0.8195  0.3522  0.4733  1
  O  O203  1  0.8208  0.0137  0.8069  1
  O  O204  1  0.8222  0.6580  0.0253  1
  O  O205  1  0.8248  0.3429  0.7576  1
  O  O206  1  0.8264  0.6641  0.4283  1
  O  O207  1  0.8282  0.3131  0.0759  1
  O  O208  1  0.8294  0.9924  0.4100  1
  O  O209  1  0.8301  0.6508  0.7422  1
  O  O210  1  0.8839  0.5974  0.2459  1
  O  O211  1  0.8849  0.8981  0.1980  1
  O  O212  1  0.8883  0.0876  0.5814  1
  O  O213  1  0.8885  0.5749  0.5243  1
  O  O214  1  0.8889  0.4183  0.9752  1
  O  O215  1  0.8895  0.7515  0.6436  1
  O  O216  1  0.8909  0.2496  0.8580  1
  O  O217  1  0.8910  0.0850  0.3067  1
  O  O218  1  0.8930  0.9229  0.9094  1
  O  O219  1  0.8953  0.2561  0.5767  1
  O  O220  1  0.9006  0.7507  0.9295  1
  O  O221  1  0.9097  0.1051  0.1882  1
  O  O222  1  0.9141  0.4254  0.2522  1
  O  O223  1  0.9144  0.9031  0.5819  1
  O  O224  1  0.9192  0.7536  0.5301  1
  O  O225  1  0.9197  0.5742  0.9230  1
  O  O226  1  0.9216  0.8969  0.3042  1
  O  O227  1  0.9270  0.2357  0.9740  1
  O  O228  1  0.9275  0.0960  0.9082  1
  O  O229  1  0.9276  0.5675  0.6390  1
  O  O230  1  0.9281  0.4293  0.8614  1
  O  O231  1  0.9329  0.2367  0.2529  1
  O  O232  1  0.9331  0.4266  0.5764  1
  O  O233  1  0.9352  0.7658  0.2489  1
]