data_[Na30Ta16Zn8Si27S9O144]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Ta  1.5000  1.4500  0.8200
  Zn  1.6500  1.3500  0.8800
  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 [9.0336]
_cell_length_b [15.6066]
_cell_length_c [22.5349]
_cell_angle_alpha [90.1841]
_cell_angle_beta [90.0768]
_cell_angle_gamma [90.1369]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Na30Ta16Zn8Si27(SO16)9]
_chemical_formula_sum '[Na30 Ta16 Zn8 Si27 S9 O144]'
_cell_volume [3177.0331]
_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
[
  Na  Na0  1  0.0009  0.9991  0.0067  1
  Na  Na1  1  0.0056  0.3305  0.8329  1
  Na  Na2  1  0.0067  0.6617  0.6779  1
  Na  Na3  1  0.1270  0.8394  0.5848  1
  Na  Na4  1  0.1667  0.4898  0.9129  1
  Na  Na5  1  0.1761  0.8165  0.2570  1
  Na  Na6  1  0.1765  0.1446  0.5858  1
  Na  Na7  1  0.1981  0.5170  0.5908  1
  Na  Na8  1  0.3010  0.0159  0.0887  1
  Na  Na9  1  0.3183  0.3438  0.4127  1
  Na  Na10  1  0.3238  0.6443  0.0840  1
  Na  Na11  1  0.3304  0.9869  0.4124  1
  Na  Na12  1  0.3724  0.3398  0.0863  1
  Na  Na13  1  0.4943  0.1629  0.1771  1
  Na  Na14  1  0.4950  0.5037  0.5062  1
  Na  Na15  1  0.4997  0.1675  0.6748  1
  Na  Na16  1  0.4999  0.8331  0.8385  1
  Na  Na17  1  0.5052  0.5046  0.0067  1
  Na  Na18  1  0.5130  0.8316  0.3347  1
  Na  Na19  1  0.6276  0.3403  0.5866  1
  Na  Na20  1  0.6776  0.6430  0.5856  1
  Na  Na21  1  0.6820  0.3442  0.9138  1
  Na  Na22  1  0.6955  0.0162  0.5844  1
  Na  Na23  1  0.8016  0.5179  0.0896  1
  Na  Na24  1  0.8232  0.1441  0.0862  1
  Na  Na25  1  0.8320  0.4886  0.4124  1
  Na  Na26  1  0.8713  0.8401  0.0840  1
  Na  Na27  1  0.9869  0.6572  0.1738  1
  Na  Na28  1  0.9909  0.9999  0.5042  1
  Na  Na29  1  0.9941  0.3298  0.3315  1
  Ta  Ta30  1  0.0014  0.6662  0.5185  1
  Ta  Ta31  1  0.0017  0.3311  0.9794  1
  Ta  Ta32  1  0.0029  0.9983  0.8595  1
  Ta  Ta33  1  0.0048  0.9987  0.3562  1
  Ta  Ta34  1  0.0060  0.3373  0.6876  1
  Ta  Ta35  1  0.4889  0.5025  0.8559  1
  Ta  Ta36  1  0.4970  0.8380  0.1853  1
  Ta  Ta37  1  0.4990  0.1653  0.0186  1
  Ta  Ta38  1  0.4996  0.8331  0.6861  1
  Ta  Ta39  1  0.5001  0.8323  0.4780  1
  Ta  Ta40  1  0.5021  0.1658  0.5188  1
  Ta  Ta41  1  0.5041  0.8340  0.9775  1
  Ta  Ta42  1  0.5103  0.5004  0.3551  1
  Ta  Ta43  1  0.9946  0.3371  0.1870  1
  Ta  Ta44  1  0.9962  0.3313  0.4798  1
  Ta  Ta45  1  0.9975  0.6671  0.0184  1
  Zn  Zn46  1  0.0080  0.6596  0.8209  1
  Zn  Zn47  1  0.0112  0.0033  0.1460  1
  Zn  Zn48  1  0.4889  0.5003  0.6475  1
  Zn  Zn49  1  0.4924  0.1595  0.3196  1
  Zn  Zn50  1  0.4996  0.1658  0.8275  1
  Zn  Zn51  1  0.5120  0.5009  0.1460  1
  Zn  Zn52  1  0.9885  0.6572  0.3208  1
  Zn  Zn53  1  0.9999  0.0008  0.6455  1
  Si  Si54  1  0.1443  0.8080  0.4120  1
  Si  Si55  1  0.1452  0.4797  0.0834  1
  Si  Si56  1  0.1468  0.1896  0.0849  1
  Si  Si57  1  0.1491  0.5211  0.4157  1
  Si  Si58  1  0.2033  0.5055  0.7466  1
  Si  Si59  1  0.2096  0.1686  0.4150  1
  Si  Si60  1  0.2096  0.8319  0.0819  1
  Si  Si61  1  0.2881  0.6718  0.9149  1
  Si  Si62  1  0.2910  0.3317  0.5826  1
  Si  Si63  1  0.2965  0.0048  0.2474  1
  Si  Si64  1  0.3514  0.3093  0.9139  1
  Si  Si65  1  0.3534  0.6887  0.5830  1
  Si  Si66  1  0.3557  0.9790  0.5833  1
  Si  Si67  1  0.3611  0.0212  0.9134  1
  Si  Si68  1  0.6454  0.6901  0.0836  1
  Si  Si69  1  0.6467  0.3070  0.4126  1
  Si  Si70  1  0.6467  0.9799  0.0829  1
  Si  Si71  1  0.6477  0.0216  0.4149  1
  Si  Si72  1  0.7087  0.3316  0.0825  1
  Si  Si73  1  0.7111  0.6706  0.4147  1
  Si  Si74  1  0.7882  0.1662  0.9142  1
  Si  Si75  1  0.7895  0.8323  0.5836  1
  Si  Si76  1  0.7976  0.5044  0.2465  1
  Si  Si77  1  0.8520  0.5214  0.9151  1
  Si  Si78  1  0.8532  0.1893  0.5859  1
  Si  Si79  1  0.8544  0.8063  0.9120  1
  Si  Si80  1  0.8545  0.4796  0.5838  1
  S  S81  1  0.1446  0.1443  0.7483  1
  S  S82  1  0.1466  0.8571  0.7478  1
  S  S83  1  0.3532  0.3546  0.2487  1
  S  S84  1  0.3563  0.6454  0.2485  1
  S  S85  1  0.6433  0.6465  0.7482  1
  S  S86  1  0.6466  0.3527  0.7487  1
  S  S87  1  0.7098  0.9997  0.7484  1
  S  S88  1  0.8519  0.8555  0.2486  1
  S  S89  1  0.8565  0.1452  0.2486  1
  O  O90  1  0.0567  0.5544  0.3612  1
  O  O91  1  0.0604  0.5725  0.0779  1
  O  O92  1  0.0615  0.4309  0.1401  1
  O  O93  1  0.0667  0.2310  0.7458  1
  O  O94  1  0.0691  0.7645  0.4730  1
  O  O95  1  0.0698  0.9075  0.4081  1
  O  O96  1  0.0704  0.0967  0.0843  1
  O  O97  1  0.0739  0.2401  0.0281  1
  O  O98  1  0.0778  0.0994  0.8011  1
  O  O99  1  0.0795  0.4238  0.4281  1
  O  O100  1  0.0843  0.7710  0.7536  1
  O  O101  1  0.0922  0.8969  0.6933  1
  O  O102  1  0.0939  0.5851  0.7530  1
  O  O103  1  0.0995  0.2499  0.4276  1
  O  O104  1  0.1016  0.9130  0.0851  1
  O  O105  1  0.1053  0.4104  0.7444  1
  O  O106  1  0.1077  0.0799  0.4082  1
  O  O107  1  0.1107  0.4194  0.0254  1
  O  O108  1  0.1127  0.7423  0.0775  1
  O  O109  1  0.1134  0.0960  0.6934  1
  O  O110  1  0.1147  0.9132  0.8008  1
  O  O111  1  0.1175  0.2537  0.1421  1
  O  O112  1  0.1183  0.5809  0.4766  1
  O  O113  1  0.1245  0.7566  0.3519  1
  O  O114  1  0.1715  0.6851  0.5779  1
  O  O115  1  0.1750  0.0112  0.9062  1
  O  O116  1  0.1761  0.3314  0.9250  1
  O  O117  1  0.1771  0.3141  0.6395  1
  O  O118  1  0.1791  0.9861  0.3060  1
  O  O119  1  0.1795  0.9893  0.5883  1
  O  O120  1  0.1807  0.3445  0.5256  1
  O  O121  1  0.1846  0.3487  0.2468  1
  O  O122  1  0.1850  0.6480  0.9751  1
  O  O123  1  0.1981  0.6614  0.2543  1
  O  O124  1  0.1986  0.0067  0.1879  1
  O  O125  1  0.1987  0.6874  0.8565  1
  O  O126  1  0.3004  0.5103  0.6873  1
  O  O127  1  0.3044  0.1568  0.7537  1
  O  O128  1  0.3066  0.1965  0.3605  1
  O  O129  1  0.3139  0.1476  0.4756  1
  O  O130  1  0.3170  0.8515  0.7453  1
  O  O131  1  0.3177  0.8146  0.1424  1
  O  O132  1  0.3194  0.4899  0.8061  1
  O  O133  1  0.3208  0.8299  0.4253  1
  O  O134  1  0.3216  0.4890  0.0890  1
  O  O135  1  0.3262  0.8461  0.0284  1
  O  O136  1  0.3284  0.1840  0.0768  1
  O  O137  1  0.3287  0.5059  0.4079  1
  O  O138  1  0.3724  0.2564  0.8553  1
  O  O139  1  0.3833  0.4103  0.3036  1
  O  O140  1  0.3837  0.0822  0.9743  1
  O  O141  1  0.3843  0.5965  0.1939  1
  O  O142  1  0.3845  0.7534  0.6415  1
  O  O143  1  0.3877  0.9191  0.5257  1
  O  O144  1  0.3881  0.2425  0.5776  1
  O  O145  1  0.3916  0.9078  0.2456  1
  O  O146  1  0.3933  0.5809  0.9089  1
  O  O147  1  0.3977  0.4138  0.5841  1
  O  O148  1  0.4042  0.7490  0.9271  1
  O  O149  1  0.4043  0.0852  0.2534  1
  O  O150  1  0.4070  0.3971  0.1947  1
  O  O151  1  0.4188  0.2704  0.2546  1
  O  O152  1  0.4200  0.5996  0.3019  1
  O  O153  1  0.4228  0.9254  0.9269  1
  O  O154  1  0.4269  0.7407  0.5281  1
  O  O155  1  0.4302  0.5966  0.5846  1
  O  O156  1  0.4319  0.0570  0.8548  1
  O  O157  1  0.4325  0.4074  0.9084  1
  O  O158  1  0.4343  0.2680  0.9741  1
  O  O159  1  0.4347  0.7324  0.2473  1
  O  O160  1  0.4387  0.9302  0.6407  1
  O  O161  1  0.4408  0.0723  0.5789  1
  O  O162  1  0.5530  0.0547  0.3609  1
  O  O163  1  0.5609  0.0726  0.0773  1
  O  O164  1  0.5616  0.9332  0.1410  1
  O  O165  1  0.5636  0.7340  0.7456  1
  O  O166  1  0.5658  0.2671  0.4744  1
  O  O167  1  0.5676  0.4060  0.4080  1
  O  O168  1  0.5700  0.5968  0.0850  1
  O  O169  1  0.5721  0.7403  0.0280  1
  O  O170  1  0.5750  0.9264  0.4286  1
  O  O171  1  0.5766  0.6014  0.8012  1
  O  O172  1  0.5824  0.2669  0.7537  1
  O  O173  1  0.5921  0.3943  0.6945  1
  O  O174  1  0.5957  0.7485  0.4270  1
  O  O175  1  0.6028  0.4137  0.0840  1
  O  O176  1  0.6069  0.5803  0.4087  1
  O  O177  1  0.6118  0.2425  0.0775  1
  O  O178  1  0.6122  0.0738  0.7540  1
  O  O179  1  0.6128  0.9169  0.0276  1
  O  O180  1  0.6141  0.5989  0.6933  1
  O  O181  1  0.6154  0.7541  0.1420  1
  O  O182  1  0.6159  0.9170  0.7454  1
  O  O183  1  0.6170  0.4073  0.8032  1
  O  O184  1  0.6183  0.0813  0.4765  1
  O  O185  1  0.6203  0.2517  0.3557  1
  O  O186  1  0.6713  0.1838  0.5776  1
  O  O187  1  0.6719  0.5063  0.9068  1
  O  O188  1  0.6763  0.8471  0.5284  1
  O  O189  1  0.6764  0.8150  0.6416  1
  O  O190  1  0.6784  0.4893  0.5891  1
  O  O191  1  0.6799  0.8258  0.9260  1
  O  O192  1  0.6813  0.4897  0.3064  1
  O  O193  1  0.6849  0.8477  0.2464  1
  O  O194  1  0.6855  0.1502  0.9750  1
  O  O195  1  0.6947  0.1948  0.8583  1
  O  O196  1  0.6986  0.1590  0.2556  1
  O  O197  1  0.6987  0.5102  0.1876  1
  O  O198  1  0.7963  0.0072  0.6933  1
  O  O199  1  0.8020  0.6611  0.7550  1
  O  O200  1  0.8022  0.6897  0.3574  1
  O  O201  1  0.8098  0.9878  0.8010  1
  O  O202  1  0.8142  0.6480  0.4752  1
  O  O203  1  0.8157  0.3470  0.7462  1
  O  O204  1  0.8185  0.3446  0.0256  1
  O  O205  1  0.8221  0.3303  0.4251  1
  O  O206  1  0.8222  0.9903  0.0898  1
  O  O207  1  0.8227  0.3143  0.1396  1
  O  O208  1  0.8279  0.0111  0.4072  1
  O  O209  1  0.8280  0.6843  0.0779  1
  O  O210  1  0.8780  0.7508  0.8546  1
  O  O211  1  0.8811  0.5808  0.9762  1
  O  O212  1  0.8817  0.2536  0.6426  1
  O  O213  1  0.8827  0.9115  0.3022  1
  O  O214  1  0.8840  0.0968  0.1936  1
  O  O215  1  0.8878  0.7441  0.5772  1
  O  O216  1  0.8884  0.4193  0.5257  1
  O  O217  1  0.8934  0.9155  0.5887  1
  O  O218  1  0.8953  0.4101  0.2446  1
  O  O219  1  0.8958  0.0808  0.9055  1
  O  O220  1  0.8977  0.2490  0.9271  1
  O  O221  1  0.9058  0.5849  0.2530  1
  O  O222  1  0.9088  0.8960  0.1943  1
  O  O223  1  0.9191  0.4237  0.9277  1
  O  O224  1  0.9218  0.7718  0.2546  1
  O  O225  1  0.9234  0.0990  0.3015  1
  O  O226  1  0.9253  0.0951  0.5878  1
  O  O227  1  0.9278  0.2379  0.5286  1
  O  O228  1  0.9313  0.9057  0.9048  1
  O  O229  1  0.9324  0.7667  0.9745  1
  O  O230  1  0.9376  0.2312  0.2465  1
  O  O231  1  0.9390  0.4310  0.6402  1
  O  O232  1  0.9390  0.5728  0.5777  1
  O  O233  1  0.9448  0.5536  0.8604  1
]