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{
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"structure_string": "Mg2 H4 C6 O8\n1.0\n4.604879 0.024797 1.885982\n2.664707 6.368579 -0.134467\n-0.195111 -0.162247 6.041826\nMg H C O\n2 4 6 8\ndirect\n0.523892 0.191799 0.526973 Mg\n0.900513 0.103082 0.967648 Mg\n0.307871 0.929708 0.339596 H\n0.064651 0.644893 0.684660 H\n0.469644 0.638365 0.327636 H\n0.805565 0.658849 -0.028353 H\n0.827625 0.651973 0.782604 C\n0.294337 0.777393 0.311748 C\n0.588170 0.857077 0.779716 C\n0.809784 0.447043 0.709269 C\n0.185043 0.380557 0.197800 C\n0.056235 0.774628 0.260828 C\n0.445844 0.328681 0.223986 O\n0.002026 0.588306 0.221888 O\n0.583282 0.435369 0.671259 O\n0.070415 0.254793 0.158707 O\n0.328924 0.872056 0.783040 O\n0.825596 0.940631 0.248105 O\n0.665686 0.018818 0.773359 O\n0.046035 0.277791 0.695817 O\n",
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{
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"structure_string": "Li6 Cu2 F12\n1.0\n5.893511 0.002436 0.002494\n-0.129821 5.892082 0.002494\n-0.129821 -0.132767 5.890587\nLi Cu F\n6 2 12\ndirect\n0.066756 0.249200 0.556501 Li\n0.249200 0.556501 0.066755 Li\n0.443499 0.933244 0.750799 Li\n0.556501 0.066756 0.249200 Li\n0.750800 0.443499 0.933244 Li\n0.933245 0.750800 0.443498 Li\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n0.806630 0.452669 0.599448 F\n0.694843 0.076607 0.917740 F\n0.599448 0.806629 0.452668 F\n0.547331 0.400552 0.193370 F\n0.452669 0.599448 0.806629 F\n0.082261 0.305157 0.923393 F\n0.305158 0.923393 0.082260 F\n0.193371 0.547331 0.400552 F\n0.917740 0.694843 0.076606 F\n0.076608 0.917739 0.694842 F\n0.400552 0.193370 0.547331 F\n0.923393 0.082261 0.305157 F\n",
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"updated_at": "2022-09-04T14:36:48.478604Z",
"structure_string": "Mo2 H8 O10\n1.0\n3.978350 -0.000226 -0.000054\n0.000299 6.607505 0.106331\n0.000148 1.714950 7.712228\nMo H O\n2 8 10\ndirect\n0.037602 -0.014436 0.247287 Mo\n0.962518 -0.014437 0.747287 Mo\n-0.239143 0.661577 0.175787 H\n0.358019 0.426784 0.553005 H\n0.836285 0.369733 0.625750 H\n0.239251 0.661579 0.675791 H\n0.642110 0.426786 0.053003 H\n0.163843 0.369737 0.125749 H\n0.368122 0.595471 0.943926 H\n0.632005 0.595469 0.443929 H\n0.040907 0.271852 0.649252 O\n-0.002051 -0.026238 0.969574 O\n0.002167 -0.026240 0.469576 O\n0.460031 0.528548 0.060863 O\n0.540102 0.528545 0.560868 O\n0.472129 -0.006125 0.221439 O\n0.527991 -0.006127 0.721438 O\n0.908359 0.699313 0.265881 O\n-0.040790 0.271858 0.149253 O\n0.091751 0.699317 0.765882 O\n",
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{
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"created_at": "2022-09-04T14:37:00.990812Z",
"updated_at": "2022-09-04T14:37:00.990832Z",
"structure_string": "Rb12 Al2 Sb6\n1.0\n0.000000 10.616288 0.011612\n6.230563 0.000000 0.000000\n0.000000 -2.308118 -12.161553\nRb Al Sb\n12 2 6\ndirect\n0.120172 0.750000 0.672991 Rb\n0.904927 0.250000 0.633994 Rb\n0.095073 0.750000 0.366006 Rb\n0.755047 0.750000 0.784560 Rb\n0.541051 0.250000 0.077636 Rb\n0.458949 0.750000 0.922364 Rb\n0.244953 0.250000 0.215440 Rb\n0.447732 0.750000 0.549158 Rb\n0.867699 0.250000 0.980646 Rb\n0.132301 0.750000 0.019354 Rb\n0.879828 0.250000 0.327009 Rb\n0.552268 0.250000 0.450842 Rb\n0.676581 0.750000 0.280234 Al\n0.323419 0.250000 0.719765 Al\n0.821612 0.750000 0.122762 Sb\n0.424640 0.750000 0.228130 Sb\n0.575360 0.250000 0.771870 Sb\n0.788804 0.750000 0.489772 Sb\n0.211196 0.250000 0.510228 Sb\n0.178388 0.250000 0.877238 Sb\n",
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{
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"structure_string": "Na2 H6 S2 O10\n1.0\n3.369743 3.873931 -1.947130\n-3.369743 3.873931 1.947130\n-0.038891 0.000000 8.163178\nNa H S O\n2 6 2 10\ndirect\n0.948420 0.496464 0.491771 Na\n0.503535 0.051580 0.991771 Na\n0.303088 0.597284 0.780343 H\n0.402716 0.696912 0.280343 H\n0.495723 0.528869 0.695130 H\n0.471131 0.504277 0.195130 H\n0.822907 0.591537 0.002184 H\n0.408463 0.177093 0.502184 H\n0.126038 0.137416 0.244790 S\n0.862583 0.873962 0.744790 S\n0.355005 0.462141 0.740768 O\n0.775365 0.687047 0.653099 O\n0.312953 0.224635 0.153099 O\n0.717991 0.141306 0.629014 O\n0.858693 0.282009 0.129013 O\n0.777750 0.789495 0.922039 O\n0.210505 0.222250 0.422039 O\n0.146967 0.870891 0.813862 O\n0.129109 0.853033 0.313862 O\n0.537858 0.644995 0.240768 O\n",
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{
"id": "jvasp-45729",
"created_at": "2022-09-04T14:37:02.772553Z",
"updated_at": "2022-09-04T14:37:02.772579Z",
"structure_string": "Ca2 Ho2 Ti4 O12\n1.0\n5.341652 0.000000 0.000000\n0.000000 5.565689 0.000000\n0.000000 0.000000 7.667888\nCa Ho Ti O\n2 2 4 12\ndirect\n0.488447 0.196139 0.000000 Ca\n0.988447 0.803861 0.500000 Ca\n0.016712 0.684027 0.000000 Ho\n0.516712 0.315973 0.500000 Ho\n0.000676 0.246257 0.750223 Ti\n0.000676 0.246257 0.249778 Ti\n0.500675 0.753743 0.250223 Ti\n0.500675 0.753743 0.749778 Ti\n0.795333 0.541480 0.701801 O\n0.691191 0.054954 0.696610 O\n0.691191 0.054954 0.303390 O\n0.607237 0.778851 0.000000 O\n0.413282 0.718599 0.500000 O\n0.191191 0.945046 0.803390 O\n0.295333 0.458521 0.798200 O\n0.191191 0.945046 0.196610 O\n0.795333 0.541480 0.298199 O\n0.107237 0.221150 0.500000 O\n0.295333 0.458521 0.201801 O\n0.913282 0.281402 0.000000 O\n",
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{
"id": "jvasp-52906",
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"updated_at": "2022-09-04T14:36:54.896476Z",
"structure_string": "Zn4 H8 O8\n1.0\n4.897610 0.000000 0.000000\n0.000000 5.243935 0.000000\n0.000000 0.000000 8.165770\nZn H O\n4 8 8\ndirect\n0.936268 0.152507 0.873135 Zn\n0.563732 0.847493 0.373135 Zn\n0.436268 0.347493 0.126865 Zn\n0.063732 0.652508 0.626865 Zn\n0.195114 0.929796 0.111476 H\n0.304886 0.070205 0.611476 H\n0.804886 0.429796 0.388524 H\n0.695114 0.570205 0.888524 H\n0.134458 0.639382 0.286031 H\n0.865542 0.139381 0.213969 H\n0.634458 0.860620 0.713969 H\n0.365542 0.360619 0.786031 H\n0.305829 0.668772 0.220594 O\n0.867541 0.606293 0.417262 O\n0.632459 0.393708 0.917262 O\n0.367541 0.893709 0.582738 O\n0.132459 0.106292 0.082738 O\n0.805829 0.831229 0.779406 O\n0.694171 0.168772 0.279406 O\n0.194171 0.331228 0.720594 O\n",
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{
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"created_at": "2022-09-04T14:36:54.390253Z",
"updated_at": "2022-09-04T14:36:54.390282Z",
"structure_string": "Ce2 B6 O12\n1.0\n5.689142 -0.016672 2.953521\n-0.167438 5.686702 2.953521\n-0.012716 -0.013057 6.431869\nCe B O\n2 6 12\ndirect\n0.801170 0.198829 0.750000 Ce\n0.198829 0.801170 0.250000 Ce\n0.792357 0.657450 0.916973 B\n0.342549 0.207641 0.583028 B\n0.220628 0.779371 0.750001 B\n0.657450 0.792358 0.416973 B\n0.779371 0.220629 0.250000 B\n0.207641 0.342549 0.083028 B\n0.218387 0.994384 0.785789 O\n0.786496 0.612260 0.500266 O\n0.387739 0.213503 0.999735 O\n0.789731 0.414336 0.009076 O\n0.585664 0.210268 0.490925 O\n0.210268 0.585664 0.990925 O\n0.414335 0.789731 0.509076 O\n0.781612 0.005615 0.214212 O\n0.994384 0.218388 0.285789 O\n0.612260 0.786497 0.000266 O\n0.005614 0.781612 0.714212 O\n0.213503 0.387740 0.499735 O\n",
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"structure_string": "Sm8 C12\n1.0\n6.907681 0.000000 -2.442235\n-3.453841 5.982227 -2.442235\n0.000000 0.000000 7.326703\nSm C\n8 12\ndirect\n0.396850 0.500000 0.000001 Sm\n0.000000 0.396850 0.500000 Sm\n0.500000 -0.000000 0.396850 Sm\n0.896850 0.500000 0.000001 Sm\n0.103150 0.103150 0.103150 Sm\n0.000000 0.896850 0.500001 Sm\n0.603150 0.603151 0.603151 Sm\n0.500000 -0.000000 0.896850 Sm\n0.453378 0.250000 0.703378 C\n0.046623 0.750000 0.796623 C\n0.203378 0.750000 0.953378 C\n0.796622 0.046622 0.750000 C\n0.750000 0.953378 0.203379 C\n0.750000 0.796623 0.046624 C\n0.250000 0.546623 0.296623 C\n0.546622 0.296622 0.250001 C\n0.250000 0.703378 0.453378 C\n0.703378 0.453378 0.250001 C\n0.953378 0.203378 0.750000 C\n0.296622 0.250000 0.546623 C\n",
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{
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"created_at": "2022-09-04T14:36:41.459591Z",
"updated_at": "2022-09-04T14:36:41.459609Z",
"structure_string": "Sn4 Br16\n1.0\n0.000000 10.226287 -0.098152\n6.910093 0.000000 0.000000\n0.000000 -2.199473 -10.106702\nSn Br\n4 16\ndirect\n0.246630 0.080380 0.870701 Sn\n0.753371 0.580380 0.629298 Sn\n0.753371 0.919620 0.129299 Sn\n0.246630 0.419620 0.370701 Sn\n0.562373 0.089090 0.194246 Br\n0.437628 0.589089 0.305753 Br\n0.313575 0.418271 0.932922 Br\n0.686425 0.918270 0.567077 Br\n0.686425 0.581729 0.067077 Br\n0.313575 0.081729 0.432922 Br\n0.053603 0.077627 0.680951 Br\n0.946397 0.922373 0.319048 Br\n0.562373 0.410910 0.694246 Br\n0.053603 0.422373 0.180951 Br\n0.186464 0.591770 0.560669 Br\n0.813537 0.091770 0.939330 Br\n0.813536 0.408230 0.439330 Br\n0.186464 0.908230 0.060669 Br\n0.946398 0.577627 0.819048 Br\n0.437628 0.910910 0.805753 Br\n",
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"structure_string": "V4 O4 F12\n1.0\n5.097471 0.000000 0.000000\n0.000000 5.561805 -0.108202\n0.000000 0.035944 9.395217\nV O F\n4 4 12\ndirect\n0.913550 0.673918 0.376097 V\n0.586449 0.673917 0.876097 V\n0.413550 0.326081 0.123904 V\n0.086450 0.326081 0.623904 V\n0.337361 0.198369 0.557977 O\n0.837361 0.801629 0.942024 O\n0.162639 0.198369 0.057977 O\n0.662638 0.801630 0.442024 O\n0.790948 0.547192 0.211956 F\n0.603720 0.088297 0.185907 F\n0.365572 0.653599 0.044531 F\n0.634428 0.346400 0.955469 F\n0.709052 0.547191 0.711956 F\n0.896280 0.088297 0.685908 F\n0.209052 0.452807 0.788045 F\n0.290948 0.452807 0.288044 F\n0.865572 0.346400 0.455469 F\n0.103720 0.911701 0.314093 F\n0.134428 0.653598 0.544531 F\n0.396280 0.911701 0.814093 F\n",
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{
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"created_at": "2022-09-04T14:36:41.546862Z",
"updated_at": "2022-09-04T14:36:41.546884Z",
"structure_string": "Mg4 Ta2 Sb2 O12\n1.0\n0.000000 5.528799 0.000229\n7.855421 0.000000 0.000000\n0.000000 -0.294080 -5.530057\nMg Ta Sb O\n4 2 2 12\ndirect\n0.515027 0.750000 0.467403 Mg\n0.484973 0.250000 0.532597 Mg\n0.981114 0.750000 0.968750 Mg\n0.018887 0.250000 0.031251 Mg\n0.500000 0.500000 -0.000000 Ta\n0.500000 0.000000 -0.000000 Ta\n0.000000 0.500000 0.500000 Sb\n0.000000 0.000000 0.500000 Sb\n0.366976 0.570139 0.679127 O\n0.630204 0.750000 0.087006 O\n0.633024 0.070139 0.320873 O\n0.142645 0.250000 0.385236 O\n0.191963 0.928392 0.140958 O\n0.808037 0.071608 0.859043 O\n0.191963 0.571608 0.140958 O\n0.366976 0.929861 0.679127 O\n0.857355 0.750000 0.614764 O\n0.633024 0.429861 0.320873 O\n0.808037 0.428392 0.859043 O\n0.369796 0.250000 0.912994 O\n",
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}
]
}