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"structure_string": "Sr4 Ti1 Be1\n1.0\n-0.000000 4.855937 4.855937\n4.855937 0.000000 4.855937\n4.855937 4.855937 0.000000\nSr Ti Be\n4 1 1\ndirect\n0.125607 0.624798 0.624798 Sr\n0.624798 0.624798 0.624798 Sr\n0.624798 0.125607 0.624798 Sr\n0.624798 0.624798 0.125607 Sr\n0.250000 0.250000 0.250000 Ti\n0.000000 0.000000 0.000000 Be\n",
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{
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"structure_string": "S1 N1 Cl1\n1.0\n4.263858 -0.000000 0.000000\n-2.131929 3.692609 -0.000000\n-0.000000 -0.000000 2.910751\nS N Cl\n1 1 1\ndirect\n0.666666 0.333333 0.000000 S\n0.333332 0.666666 0.000000 N\n0.000000 0.000000 0.000000 Cl\n",
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{
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"structure_string": "Na4 Zn2 Si4 O12\n1.0\n5.712424 -0.051724 -0.165853\n-2.331699 5.215136 -0.165853\n0.064938 0.099180 9.980392\nNa Zn Si O\n4 2 4 12\ndirect\n0.387335 0.741593 0.105401 Na\n0.258408 0.612666 0.394599 Na\n0.612665 0.258408 0.894599 Na\n0.741592 0.387336 0.605401 Na\n0.728909 0.271092 0.250000 Zn\n0.271091 0.728910 0.750000 Zn\n0.167278 0.138941 0.137983 Si\n0.832722 0.861061 0.862017 Si\n0.138941 0.167278 0.637983 Si\n0.861059 0.832723 0.362017 Si\n0.091352 0.367536 0.192323 O\n0.908648 0.632465 0.807677 O\n0.000000 -0.000000 0.500000 O\n0.367536 0.091353 0.692323 O\n0.470844 0.229229 0.107647 O\n0.091966 0.908035 0.250000 O\n0.229229 0.470844 0.607647 O\n0.632464 0.908649 0.307678 O\n0.770771 0.529157 0.392353 O\n0.908034 0.091967 0.750000 O\n0.529156 0.770772 0.892353 O\n0.000000 0.000000 0.000000 O\n",
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{
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"created_at": "2022-09-04T14:37:36.591734Z",
"updated_at": "2022-09-04T14:37:36.591743Z",
"structure_string": "Sn1 H8 N2 F6\n1.0\n3.035477 -5.257602 -0.000000\n3.035477 5.257602 0.000000\n-0.000000 -0.000000 4.733563\nSn H N F\n1 8 2 6\ndirect\n0.000000 0.000000 0.000000 Sn\n0.758643 0.517285 0.615563 H\n0.758643 0.241358 0.615563 H\n0.517285 0.758643 0.384437 H\n0.482716 0.241358 0.615563 H\n0.241358 0.482716 0.384437 H\n0.666667 0.333333 0.911717 H\n0.333333 0.666667 0.088283 H\n0.241358 0.758643 0.384437 H\n0.333333 0.666667 0.306682 N\n0.666667 0.333333 0.693318 N\n0.158193 0.316387 0.763738 F\n0.841808 0.683613 0.236262 F\n0.841807 0.158194 0.236262 F\n0.316387 0.158193 0.236262 F\n0.158194 0.841807 0.763738 F\n0.683613 0.841808 0.763738 F\n",
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"structure_string": "K5 Cu1 Sb2\n1.0\n5.636288 -0.001229 8.215333\n2.546317 5.028321 8.215333\n-0.002001 -0.001229 9.962903\nK Cu Sb\n5 1 2\ndirect\n0.500001 0.500000 0.499999 K\n0.364859 0.364858 0.364858 K\n0.635142 0.635141 0.635141 K\n0.217003 0.217003 0.217003 K\n0.782998 0.782997 0.782996 K\n0.000000 0.000000 0.000000 Cu\n0.089400 0.089400 0.089400 Sb\n0.910601 0.910599 0.910598 Sb\n",
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{
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"updated_at": "2022-09-04T14:36:37.133645Z",
"structure_string": "K1 Na2 Rh1 F6\n1.0\n5.382323 -0.000000 3.107485\n1.794108 5.074503 3.107485\n-0.000000 -0.000000 6.214971\nK Na Rh F\n1 2 1 6\ndirect\n0.500000 0.500000 0.500001 K\n0.750000 0.750000 0.750001 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Rh\n0.774505 0.225495 0.225496 F\n0.225495 0.225495 0.774506 F\n0.225495 0.774505 0.774506 F\n0.225495 0.774505 0.225495 F\n0.774505 0.225495 0.774506 F\n0.774505 0.774505 0.225496 F\n",
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{
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"created_at": "2022-09-04T14:37:51.733648Z",
"updated_at": "2022-09-04T14:37:51.733684Z",
"structure_string": "Sc1\n1.0\n-0.000000 -0.000000 -2.934233\n-2.075121 -2.075121 -0.000000\n-2.075121 2.075121 0.000000\nSc\n1\ndirect\n0.000000 0.000000 0.000000 Sc\n",
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{
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"created_at": "2022-09-04T14:38:26.483302Z",
"updated_at": "2022-09-04T14:38:26.483321Z",
"structure_string": "Sb4 Cl14 F6\n1.0\n7.476133 0.035048 6.368280\n3.616891 6.543080 6.368280\n0.048542 0.028785 12.698373\nSb Cl F\n4 14 6\ndirect\n0.243785 0.212183 0.821663 Sb\n0.787817 0.756215 0.178337 Sb\n0.011065 0.890586 0.276460 Sb\n0.109414 -0.011065 0.723540 Sb\n0.099341 0.450329 0.189279 Cl\n0.549670 0.900659 0.810721 Cl\n0.289891 0.135124 0.479326 Cl\n0.864876 0.710109 0.520674 Cl\n0.600743 0.650011 0.431863 Cl\n0.349989 0.399257 0.568137 Cl\n0.701269 0.697760 0.083765 Cl\n0.310649 0.605881 0.208363 Cl\n0.394118 0.689351 0.791637 Cl\n0.787255 0.282265 0.738899 Cl\n0.717735 0.212745 0.261101 Cl\n0.041077 0.839201 0.688024 Cl\n0.160799 -0.041077 0.311975 Cl\n0.302239 0.298731 0.916235 Cl\n0.119083 0.042452 0.038132 F\n0.144257 0.116838 0.787929 F\n0.883162 0.855743 0.212071 F\n-0.037603 0.423195 0.855231 F\n0.576805 0.037602 0.144768 F\n0.957547 0.880918 0.961868 F\n",
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{
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"structure_string": "Na1 F3\n1.0\n-1.635338 1.635338 4.202579\n1.635338 -1.635338 4.202579\n1.635338 1.635338 -4.202579\nNa F\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.750003 0.250001 0.500002 F\n0.250001 0.750003 0.500002 F\n0.499999 0.499999 0.000000 F\n",
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"structure_string": "Cr2 Cl6\n1.0\n5.903550 0.001421 -0.948617\n-3.178964 4.974544 -0.948617\n-0.010562 -0.019290 6.067722\nCr Cl\n2 6\ndirect\n0.166550 0.833450 -0.000001 Cr\n0.833450 0.166549 -0.000001 Cr\n0.072361 0.425000 0.768796 Cl\n0.575000 0.927639 0.231202 Cl\n0.778335 0.778334 0.766078 Cl\n0.221665 0.221665 0.233921 Cl\n0.425000 0.072360 0.768796 Cl\n0.927640 0.574999 0.231202 Cl\n",
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{
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"structure_string": "Na12 Fe4 O12\n1.0\n5.749903 -0.014267 2.163919\n2.518242 7.926131 1.816706\n-0.021276 0.031049 8.512584\nNa Fe O\n12 4 12\ndirect\n0.381456 0.251573 0.207354 Na\n0.517298 0.350087 0.826104 Na\n0.881456 0.207354 0.251574 Na\n0.968344 0.721313 0.771838 Na\n0.222819 0.021436 0.961482 Na\n0.001873 0.060181 0.633828 Na\n0.468344 0.771837 0.721314 Na\n0.722819 0.961482 0.021437 Na\n0.501874 0.633828 0.060181 Na\n0.948410 0.437113 0.523579 Na\n0.448410 0.523579 0.437114 Na\n0.017299 0.826103 0.350088 Na\n0.455906 0.877415 0.354624 Fe\n0.531463 0.123089 0.599112 Fe\n0.031463 0.599112 0.123090 Fe\n0.955906 0.354623 0.877415 Fe\n0.686807 0.688381 0.228006 O\n0.121259 0.398539 0.011142 O\n0.703067 0.282518 0.533123 O\n0.621259 0.011141 0.398539 O\n0.186807 0.228005 0.688382 O\n0.203067 0.533123 0.282519 O\n0.252665 0.787392 0.543074 O\n0.632410 0.969481 0.773231 O\n0.132411 0.773230 0.969481 O\n0.768774 0.217439 0.012432 O\n0.752664 0.543073 0.787392 O\n0.268774 0.012432 0.217439 O\n",
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}