data_[Na30La21Ta3Si18S18O144]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  La  1.1000  1.9500  1.1720
  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 [9.5959]
_cell_length_b [16.5515]
_cell_length_c [24.3559]
_cell_angle_alpha [90.2697]
_cell_angle_beta [90.1126]
_cell_angle_gamma [90.0045]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Na10La7TaSi6(SO8)6]
_chemical_formula_sum '[Na30 La21 Ta3 Si18 S18 O144]'
_cell_volume [3868.2965]
_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  0.0019  0.6715  0.8371  1
  Na  Na1  1  0.1264  0.5082  0.2483  1
  Na  Na2  1  0.1372  0.1641  0.5828  1
  Na  Na3  1  0.1380  0.8292  0.9081  1
  Na  Na4  1  0.1700  0.8147  0.2473  1
  Na  Na5  1  0.1780  0.1730  0.2484  1
  Na  Na6  1  0.1812  0.8383  0.5844  1
  Na  Na7  1  0.3076  0.6915  0.7479  1
  Na  Na8  1  0.3083  0.6426  0.4176  1
  Na  Na9  1  0.3279  0.3081  0.7551  1
  Na  Na10  1  0.3497  0.0056  0.7434  1
  Na  Na11  1  0.4630  0.4954  0.4986  1
  Na  Na12  1  0.4709  0.5100  0.0027  1
  Na  Na13  1  0.4950  0.8363  0.6617  1
  Na  Na14  1  0.5067  0.1572  0.3306  1
  Na  Na15  1  0.5073  0.8449  0.1650  1
  Na  Na16  1  0.5087  0.1734  0.8379  1
  Na  Na17  1  0.6315  0.6703  0.5880  1
  Na  Na18  1  0.6360  0.0062  0.2406  1
  Na  Na19  1  0.6413  0.3265  0.9161  1
  Na  Na20  1  0.6888  0.9902  0.5886  1
  Na  Na21  1  0.6902  0.6765  0.2460  1
  Na  Na22  1  0.6930  0.3124  0.2347  1
  Na  Na23  1  0.8141  0.1895  0.7450  1
  Na  Na24  1  0.8479  0.1698  0.0763  1
  Na  Na25  1  0.9621  0.3283  0.6699  1
  Na  Na26  1  0.9775  0.0125  0.9994  1
  Na  Na27  1  0.9830  0.3496  0.1592  1
  Na  Na28  1  0.9944  0.9997  0.4987  1
  Na  Na29  1  0.9960  0.6533  0.3329  1
  La  La30  1  0.0003  0.0013  0.3474  1
  La  La31  1  0.0007  0.3368  0.0201  1
  La  La32  1  0.0028  0.6752  0.6804  1
  La  La33  1  0.0062  0.6613  0.1790  1
  La  La34  1  0.0069  0.6681  0.4863  1
  La  La35  1  0.0242  0.6560  0.9893  1
  La  La36  1  0.4956  0.8326  0.8181  1
  La  La37  1  0.4962  0.4985  0.3498  1
  La  La38  1  0.4976  0.5041  0.8524  1
  La  La39  1  0.4997  0.4938  0.6501  1
  La  La40  1  0.5000  0.8352  0.3072  1
  La  La41  1  0.5011  0.8360  0.5184  1
  La  La42  1  0.5044  0.8317  0.0190  1
  La  La43  1  0.5072  0.1605  0.1740  1
  La  La44  1  0.5092  0.1713  0.6787  1
  La  La45  1  0.5101  0.1571  0.4890  1
  La  La46  1  0.5190  0.1659  0.9917  1
  La  La47  1  0.9894  0.3247  0.8168  1
  La  La48  1  0.9947  0.3406  0.3165  1
  La  La49  1  0.9972  0.3392  0.5131  1
  La  La50  1  0.9994  0.0092  0.8507  1
  Ta  Ta51  1  0.0145  0.9984  0.6484  1
  Ta  Ta52  1  0.5070  0.5025  0.1472  1
  Ta  Ta53  1  0.9907  0.0003  0.1550  1
  Si  Si54  1  0.1475  0.1469  0.7439  1
  Si  Si55  1  0.1507  0.8565  0.7505  1
  Si  Si56  1  0.1529  0.4893  0.4140  1
  Si  Si57  1  0.1695  0.5093  0.0914  1
  Si  Si58  1  0.2877  0.0022  0.2452  1
  Si  Si59  1  0.3135  0.6653  0.5832  1
  Si  Si60  1  0.3429  0.0166  0.5894  1
  Si  Si61  1  0.3444  0.6841  0.9148  1
  Si  Si62  1  0.3601  0.6441  0.2471  1
  Si  Si63  1  0.6468  0.3474  0.7541  1
  Si  Si64  1  0.6500  0.3254  0.0880  1
  Si  Si65  1  0.6722  0.0091  0.0903  1
  Si  Si66  1  0.7874  0.4991  0.2466  1
  Si  Si67  1  0.8165  0.1612  0.5899  1
  Si  Si68  1  0.8420  0.1807  0.9201  1
  Si  Si69  1  0.8533  0.1485  0.2480  1
  Si  Si70  1  0.8541  0.8236  0.5856  1
  Si  Si71  1  0.8547  0.8542  0.2473  1
  S  S72  1  0.1448  0.8289  0.0866  1
  S  S73  1  0.1576  0.1819  0.4173  1
  S  S74  1  0.1841  0.1574  0.0881  1
  S  S75  1  0.1969  0.5000  0.7500  1
  S  S76  1  0.1982  0.8329  0.4160  1
  S  S77  1  0.3083  0.3312  0.9147  1
  S  S78  1  0.3455  0.3179  0.5819  1
  S  S79  1  0.3504  0.9850  0.9168  1
  S  S80  1  0.3543  0.3552  0.2438  1
  S  S81  1  0.6505  0.6524  0.7484  1
  S  S82  1  0.6508  0.6837  0.4158  1
  S  S83  1  0.6522  0.9864  0.4160  1
  S  S84  1  0.6881  0.6591  0.0879  1
  S  S85  1  0.6906  0.3287  0.4159  1
  S  S86  1  0.7083  0.9978  0.7441  1
  S  S87  1  0.8076  0.8304  0.9174  1
  S  S88  1  0.8470  0.5162  0.5848  1
  S  S89  1  0.8502  0.4855  0.9164  1
  O  O90  1  0.0709  0.2357  0.7435  1
  O  O91  1  0.0770  0.9104  0.0936  1
  O  O92  1  0.0808  0.0905  0.6913  1
  O  O93  1  0.0841  0.7898  0.0366  1
  O  O94  1  0.0847  0.5817  0.4158  1
  O  O95  1  0.0869  0.2266  0.0820  1
  O  O96  1  0.0918  0.1004  0.4188  1
  O  O97  1  0.0937  0.0823  0.0924  1
  O  O98  1  0.0940  0.9164  0.6974  1
  O  O99  1  0.0981  0.8945  0.8082  1
  O  O100  1  0.0984  0.7622  0.7448  1
  O  O101  1  0.1010  0.5475  0.1468  1
  O  O102  1  0.1020  0.4323  0.4653  1
  O  O103  1  0.1048  0.4455  0.3551  1
  O  O104  1  0.1058  0.5725  0.7474  1
  O  O105  1  0.1064  0.9043  0.4168  1
  O  O106  1  0.1076  0.2262  0.4669  1
  O  O107  1  0.1093  0.4186  0.0828  1
  O  O108  1  0.1160  0.0933  0.7978  1
  O  O109  1  0.1164  0.2263  0.3664  1
  O  O110  1  0.1170  0.7560  0.4152  1
  O  O111  1  0.1171  0.4238  0.7540  1
  O  O112  1  0.1175  0.7790  0.1358  1
  O  O113  1  0.1421  0.5686  0.0378  1
  O  O114  1  0.1682  0.0051  0.5980  1
  O  O115  1  0.1702  0.6847  0.9185  1
  O  O116  1  0.1705  0.9969  0.1927  1
  O  O117  1  0.1913  0.3204  0.5777  1
  O  O118  1  0.1924  0.6623  0.2411  1
  O  O119  1  0.1943  0.9823  0.9166  1
  O  O120  1  0.1975  0.0154  0.3004  1
  O  O121  1  0.1987  0.3526  0.2457  1
  O  O122  1  0.2120  0.3375  0.9613  1
  O  O123  1  0.2145  0.6760  0.6381  1
  O  O124  1  0.2174  0.6604  0.5274  1
  O  O125  1  0.2304  0.3303  0.8614  1
  O  O126  1  0.2643  0.1691  0.1395  1
  O  O127  1  0.2768  0.1480  0.0404  1
  O  O128  1  0.2845  0.4941  0.6998  1
  O  O129  1  0.2863  0.8357  0.4663  1
  O  O130  1  0.2886  0.5109  0.7987  1
  O  O131  1  0.2894  0.8304  0.3662  1
  O  O132  1  0.2975  0.8389  0.0810  1
  O  O133  1  0.3124  0.1750  0.4184  1
  O  O134  1  0.3165  0.1568  0.7393  1
  O  O135  1  0.3237  0.5019  0.4192  1
  O  O136  1  0.3251  0.8565  0.7459  1
  O  O137  1  0.3437  0.5064  0.1001  1
  O  O138  1  0.3559  0.0805  0.5388  1
  O  O139  1  0.3753  0.2764  0.6347  1
  O  O140  1  0.3757  0.9163  0.2452  1
  O  O141  1  0.3760  0.7330  0.8558  1
  O  O142  1  0.3782  0.5963  0.3049  1
  O  O143  1  0.3897  0.0817  0.2416  1
  O  O144  1  0.3959  0.2569  0.9174  1
  O  O145  1  0.3961  0.9347  0.9635  1
  O  O146  1  0.3965  0.4083  0.1967  1
  O  O147  1  0.3985  0.9253  0.5783  1
  O  O148  1  0.4032  0.9491  0.8642  1
  O  O149  1  0.4032  0.0683  0.9211  1
  O  O150  1  0.4048  0.4004  0.5815  1
  O  O151  1  0.4050  0.4028  0.9168  1
  O  O152  1  0.4057  0.7381  0.9655  1
  O  O153  1  0.4061  0.2721  0.5354  1
  O  O154  1  0.4085  0.2717  0.2378  1
  O  O155  1  0.4103  0.5928  0.9157  1
  O  O156  1  0.4111  0.7489  0.5827  1
  O  O157  1  0.4115  0.3874  0.2956  1
  O  O158  1  0.4166  0.0506  0.6447  1
  O  O159  1  0.4243  0.5893  0.5851  1
  O  O160  1  0.4276  0.5857  0.1966  1
  O  O161  1  0.4474  0.7305  0.2470  1
  O  O162  1  0.5714  0.2565  0.7531  1
  O  O163  1  0.5773  0.6045  0.4154  1
  O  O164  1  0.5777  0.7325  0.7509  1
  O  O165  1  0.5788  0.2865  0.0323  1
  O  O166  1  0.5794  0.4164  0.1009  1
  O  O167  1  0.5846  0.0679  0.4142  1
  O  O168  1  0.5886  0.3919  0.8101  1
  O  O169  1  0.5917  0.7280  0.0823  1
  O  O170  1  0.5987  0.3995  0.7000  1
  O  O171  1  0.5992  0.5826  0.0930  1
  O  O172  1  0.5994  0.6132  0.6967  1
  O  O173  1  0.6012  0.7260  0.4666  1
  O  O174  1  0.6012  0.2553  0.4186  1
  O  O175  1  0.6038  0.4027  0.4166  1
  O  O176  1  0.6047  0.9414  0.3666  1
  O  O177  1  0.6069  0.9198  0.0803  1
  O  O178  1  0.6081  0.9444  0.4671  1
  O  O179  1  0.6090  0.6036  0.7965  1
  O  O180  1  0.6096  0.0443  0.1480  1
  O  O181  1  0.6108  0.7312  0.3664  1
  O  O182  1  0.6153  0.9261  0.7446  1
  O  O183  1  0.6201  0.0720  0.7423  1
  O  O184  1  0.6205  0.2702  0.1424  1
  O  O185  1  0.6495  0.0769  0.0416  1
  O  O186  1  0.6677  0.1819  0.9195  1
  O  O187  1  0.6724  0.4952  0.1941  1
  O  O188  1  0.6832  0.8571  0.2467  1
  O  O189  1  0.6851  0.1652  0.2428  1
  O  O190  1  0.6882  0.8452  0.5774  1
  O  O191  1  0.6917  0.5127  0.5864  1
  O  O192  1  0.6943  0.4864  0.9144  1
  O  O193  1  0.6952  0.5085  0.3018  1
  O  O194  1  0.7064  0.1377  0.5399  1
  O  O195  1  0.7180  0.8380  0.9663  1
  O  O196  1  0.7201  0.8277  0.8669  1
  O  O197  1  0.7322  0.1783  0.6467  1
  O  O198  1  0.7691  0.6696  0.1390  1
  O  O199  1  0.7746  0.3235  0.3643  1
  O  O200  1  0.7779  0.6483  0.0396  1
  O  O201  1  0.7845  0.3320  0.4642  1
  O  O202  1  0.7920  0.0036  0.7946  1
  O  O203  1  0.8014  0.9936  0.6944  1
  O  O204  1  0.8030  0.6617  0.7490  1
  O  O205  1  0.8034  0.6739  0.4171  1
  O  O206  1  0.8057  0.9941  0.4182  1
  O  O207  1  0.8170  0.3338  0.7517  1
  O  O208  1  0.8204  0.3288  0.0830  1
  O  O209  1  0.8486  0.0071  0.0967  1
  O  O210  1  0.8613  0.7580  0.6351  1
  O  O211  1  0.8746  0.0913  0.3007  1
  O  O212  1  0.8794  0.2314  0.8631  1
  O  O213  1  0.8802  0.4146  0.2457  1
  O  O214  1  0.8815  0.5645  0.5354  1
  O  O215  1  0.8879  0.4389  0.9657  1
  O  O216  1  0.8883  0.5791  0.2428  1
  O  O217  1  0.8953  0.7559  0.9199  1
  O  O218  1  0.8974  0.2297  0.9746  1
  O  O219  1  0.9010  0.5557  0.6349  1
  O  O220  1  0.9045  0.9172  0.1951  1
  O  O221  1  0.9046  0.9013  0.9162  1
  O  O222  1  0.9050  0.5693  0.9198  1
  O  O223  1  0.9052  0.4334  0.5818  1
  O  O224  1  0.9067  0.4464  0.8662  1
  O  O225  1  0.9085  0.0740  0.5989  1
  O  O226  1  0.9089  0.0895  0.9195  1
  O  O227  1  0.9155  0.7635  0.2384  1
  O  O228  1  0.9179  0.0915  0.1939  1
  O  O229  1  0.9253  0.8913  0.3018  1
  O  O230  1  0.9281  0.2334  0.5778  1
  O  O231  1  0.9298  0.9123  0.6021  1
  O  O232  1  0.9407  0.7892  0.5329  1
  O  O233  1  0.9448  0.2324  0.2483  1
]