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{
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{
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"structure_string": "Ba4 Zn1 Pb1\n1.0\n-0.000000 5.051475 5.051475\n5.051475 0.000000 5.051475\n5.051475 5.051475 0.000000\nBa Zn Pb\n4 1 1\ndirect\n0.127747 0.624085 0.624085 Ba\n0.624085 0.624085 0.624085 Ba\n0.624085 0.127747 0.624085 Ba\n0.624085 0.624085 0.127747 Ba\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Pb\n",
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{
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"updated_at": "2022-09-04T14:35:54.214770Z",
"structure_string": "Ba4 Mg1 Zr1\n1.0\n-0.000000 5.051452 5.051452\n5.051452 0.000000 5.051452\n5.051452 5.051452 -0.000000\nBa Mg Zr\n4 1 1\ndirect\n0.123922 0.625359 0.625359 Ba\n0.625359 0.625359 0.625359 Ba\n0.625359 0.123922 0.625359 Ba\n0.625359 0.625359 0.123922 Ba\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Zr\n",
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{
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"structure_string": "Ba2 Nb4 O12\n1.0\n3.949363 0.000000 -0.012194\n0.000000 6.192435 0.000000\n0.032256 0.000000 10.541054\nBa Nb O\n2 4 12\ndirect\n0.000001 0.500000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.500304 0.047306 0.652112 Nb\n0.499696 0.547305 0.847888 Nb\n0.499696 0.952694 0.347888 Nb\n0.500304 0.452694 0.152112 Nb\n0.500015 0.889678 0.807411 O\n0.499985 0.389679 0.692589 O\n0.499954 0.303294 0.959413 O\n0.000056 0.405175 0.152701 O\n0.499954 0.196706 0.459414 O\n0.500015 0.610320 0.307411 O\n0.499985 0.110321 0.192589 O\n0.000057 0.094825 0.652701 O\n0.999944 0.594824 0.847299 O\n0.999944 0.905175 0.347299 O\n0.500046 0.696705 0.040587 O\n0.500046 0.803294 0.540586 O\n",
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"updated_at": "2022-09-04T14:37:37.677988Z",
"structure_string": "K4 Hf2 F12\n1.0\n6.568142 -0.000000 0.083024\n3.284071 5.700786 0.041513\n0.019704 -0.000000 6.884717\nK Hf F\n4 2 12\ndirect\n0.674636 0.688053 0.998636 K\n0.637310 0.688053 0.501364 K\n0.362688 0.311948 0.498636 K\n0.325363 0.311948 0.001364 K\n0.950795 0.098407 0.750000 Hf\n0.049203 0.901594 0.250000 Hf\n0.385913 0.609386 0.226082 F\n0.004700 0.609386 0.273918 F\n0.721979 0.974712 0.723411 F\n0.930491 0.198849 0.046129 F\n0.696690 0.025289 0.223411 F\n0.995299 0.390614 0.726082 F\n0.614085 0.390614 0.773917 F\n0.129340 0.801151 0.546129 F\n0.069508 0.801151 0.953871 F\n0.870659 0.198849 0.453870 F\n0.278020 0.025289 0.276588 F\n0.303309 0.974712 0.776588 F\n",
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{
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"created_at": "2022-09-04T14:36:05.109872Z",
"updated_at": "2022-09-04T14:36:05.109895Z",
"structure_string": "Ba4 Be1 Cl1\n1.0\n-0.000000 5.051312 5.051312\n5.051312 -0.000000 5.051312\n5.051312 5.051312 0.000000\nBa Be Cl\n4 1 1\ndirect\n0.124999 0.625000 0.625000 Ba\n0.625000 0.625000 0.625000 Ba\n0.625000 0.124999 0.625000 Ba\n0.625000 0.625000 0.124999 Ba\n0.250000 0.250000 0.250000 Be\n0.000000 0.000000 0.000000 Cl\n",
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{
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"created_at": "2022-09-04T14:38:52.338724Z",
"updated_at": "2022-09-04T14:38:52.338751Z",
"structure_string": "Cr3 Co1 P4 O16\n1.0\n5.640612 -0.000000 0.000000\n0.000000 4.698160 0.036831\n-0.000000 -0.000132 9.726031\nCr Co P O\n3 1 4 16\ndirect\n-0.000000 0.446785 0.770181 Cr\n0.500000 0.556491 0.230539 Cr\n0.500000 0.946045 0.732352 Cr\n-0.000000 0.058034 0.268833 Co\n0.500000 0.123114 0.411992 P\n0.500000 0.382103 0.915269 P\n-0.000000 0.608489 0.085617 P\n-0.000000 0.887297 0.587272 P\n0.787813 0.731537 0.666894 O\n0.500000 0.804531 0.385479 O\n0.500000 0.701981 0.891337 O\n0.216289 0.754118 0.161892 O\n0.783711 0.754118 0.161892 O\n-0.000000 0.684568 0.932677 O\n0.500000 0.312388 0.067990 O\n-0.000000 0.206107 0.612060 O\n0.288442 0.228929 0.836099 O\n-0.000000 0.287581 0.105427 O\n0.212187 0.731537 0.666894 O\n0.710022 0.282622 0.335765 O\n0.289978 0.282622 0.335765 O\n0.500000 0.178713 0.566031 O\n0.711557 0.228929 0.836099 O\n-0.000000 0.821366 0.435645 O\n",
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{
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"structure_string": "Na6 V2 S2 O6\n1.0\n6.361065 -0.004812 0.686450\n0.615845 6.331185 0.686450\n-0.005307 -0.004812 6.397994\nNa V S O\n6 2 2 6\ndirect\n0.707610 0.090448 0.400963 Na\n0.590446 0.207611 0.900963 Na\n0.207609 0.900963 0.590447 Na\n0.400962 0.707610 0.090447 Na\n0.090446 0.400963 0.707610 Na\n0.900962 0.590447 0.207610 Na\n0.681062 0.681063 0.681063 V\n0.181063 0.181063 0.181063 V\n0.498231 0.498232 0.498232 S\n-0.001768 -0.001768 -0.001768 S\n0.534523 0.915645 0.725703 O\n0.725702 0.534524 0.915645 O\n0.915644 0.725704 0.534524 O\n0.225703 0.415645 0.034524 O\n0.415645 0.034525 0.225704 O\n0.034524 0.225704 0.415645 O\n",
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"structure_string": "Li2 H6 Se4 O12\n1.0\n0.000000 5.449878 -0.002577\n7.881202 0.000000 0.000000\n0.000000 -3.788114 -5.998148\nLi H Se O\n2 6 4 12\ndirect\n0.480417 0.243104 0.002280 Li\n0.480418 0.756896 0.502280 Li\n0.570510 0.144327 0.668541 H\n0.570510 0.855673 0.168541 H\n0.463106 0.393054 0.391173 H\n0.463106 0.606945 0.891173 H\n0.970794 0.230424 0.447467 H\n0.970795 0.769576 0.947467 H\n0.139116 0.099564 0.223968 Se\n0.139116 0.900435 0.723968 Se\n0.865130 0.395824 0.776353 Se\n0.865129 0.604175 0.276353 Se\n0.399001 0.023495 0.479583 O\n0.672381 0.224619 0.808050 O\n0.672381 0.775381 0.308050 O\n0.295708 0.277898 0.193635 O\n0.295709 0.722101 0.693635 O\n0.067206 0.292665 0.699046 O\n0.067205 0.707334 0.199046 O\n0.887839 0.202545 0.284519 O\n0.887839 0.797455 0.784519 O\n0.574562 0.482424 0.519579 O\n0.574562 0.517576 0.019579 O\n0.399002 0.976505 0.979583 O\n",
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"structure_string": "Ba4 Sb2\n1.0\n5.025206 -0.000000 -1.367378\n-0.372069 5.011412 -1.367378\n0.073959 0.079653 10.189475\nBa Sb\n4 2\ndirect\n0.319422 0.319421 0.638843 Ba\n0.680579 0.680578 0.361157 Ba\n-0.000000 0.500000 -0.000000 Ba\n0.500000 0.000000 -0.000000 Ba\n0.865913 0.865911 0.731823 Sb\n0.134088 0.134088 0.268177 Sb\n",
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"structure_string": "Li2 V2 P4 O14\n1.0\n5.767814 -0.033580 0.012255\n0.776278 7.008988 0.015021\n2.821168 1.425049 6.378844\nLi V P O\n2 2 4 14\ndirect\n0.909813 0.349196 0.175245 Li\n0.090187 0.650804 0.824754 Li\n0.708310 0.193478 0.892368 V\n0.291690 0.806523 0.107632 V\n0.226377 0.189212 0.763325 P\n0.339010 0.352545 0.313007 P\n0.660990 0.647455 0.686993 P\n0.773623 0.810788 0.236675 P\n0.598841 0.741255 0.477707 O\n0.889531 0.737039 0.673903 O\n0.925673 0.643887 0.140051 O\n0.408334 0.691694 0.859830 O\n0.326930 0.574709 0.302242 O\n0.673070 0.425291 0.697758 O\n0.401159 0.258745 0.522293 O\n0.074327 0.356113 0.859949 O\n0.110469 0.262962 0.326097 O\n0.590375 0.916260 0.132542 O\n0.409625 0.083740 0.867458 O\n0.973469 0.953480 0.215310 O\n0.591666 0.308307 0.140170 O\n0.026531 0.046521 0.784690 O\n",
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}