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{
"id": "jvasp-56656",
"created_at": "2022-09-04T14:38:33.033431Z",
"updated_at": "2022-09-04T14:38:33.033461Z",
"structure_string": "Ti4 Mn2 O8\n1.0\n5.243260 0.000000 3.027197\n1.747753 4.943393 3.027197\n-0.000000 -0.000000 6.054395\nTi Mn O\n4 2 8\ndirect\n0.500000 0.500000 0.000001 Ti\n0.500000 -0.000000 0.500000 Ti\n0.500000 0.500000 0.500000 Ti\n-0.000000 0.500000 0.500000 Ti\n0.125000 0.125000 0.125000 Mn\n0.875000 0.874999 0.875001 Mn\n0.740018 0.740018 0.279945 O\n0.259981 0.259981 0.259982 O\n0.259981 0.259981 0.720056 O\n0.279944 0.740018 0.740019 O\n0.740018 0.279944 0.740018 O\n0.259981 0.720056 0.259982 O\n0.740018 0.740018 0.740019 O\n0.720056 0.259981 0.259982 O\n",
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{
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"structure_string": "La6 Ga2 Cu2 Se14\n1.0\n10.698348 0.000000 0.000000\n-5.349175 9.265041 0.000000\n0.000000 -0.000000 6.204147\nLa Ga Cu Se\n6 2 2 14\ndirect\n0.139869 0.774758 0.082620 La\n0.225242 0.365111 0.082620 La\n0.634889 0.860131 0.082620 La\n0.860131 0.225242 0.582620 La\n0.774758 0.634889 0.582620 La\n0.365111 0.139869 0.582620 La\n0.333333 0.666667 0.495281 Ga\n0.666667 0.333333 0.995282 Ga\n0.000000 0.000000 0.108053 Cu\n0.000000 0.000000 0.608054 Cu\n0.572802 0.090109 0.848563 Se\n0.482692 0.572802 0.348563 Se\n0.090108 0.517308 0.348563 Se\n0.427198 0.909891 0.348563 Se\n0.666667 0.333333 0.380966 Se\n0.333333 0.666667 0.880966 Se\n0.901832 0.157013 0.096470 Se\n0.098168 0.842987 0.596471 Se\n0.744818 0.901832 0.596471 Se\n0.842987 0.744819 0.096470 Se\n0.909891 0.482692 0.848563 Se\n0.255181 0.098168 0.096470 Se\n0.157013 0.255181 0.596471 Se\n0.517308 0.427198 0.848563 Se\n",
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{
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"updated_at": "2022-09-04T14:38:33.024468Z",
"structure_string": "Ni2 B8 O14\n1.0\n5.211394 0.000000 -0.000000\n0.000000 5.501047 -3.105435\n-0.000000 -0.016580 6.317037\nNi B O\n2 8 14\ndirect\n0.749999 0.737500 0.737500 Ni\n0.250000 0.262501 0.262500 Ni\n0.250000 0.934363 0.703141 B\n0.000000 0.700796 0.299204 B\n0.500000 0.700796 0.299204 B\n0.749999 0.296859 0.065638 B\n0.000000 0.299204 0.700796 B\n0.250000 0.703141 0.934362 B\n0.749999 0.065638 0.296859 B\n0.500000 0.299204 0.700796 B\n0.976536 0.438677 0.186862 O\n0.523463 0.186862 0.438677 O\n0.749999 0.799106 0.245430 O\n0.749999 0.245431 0.799106 O\n0.023464 0.561323 0.813138 O\n0.250000 0.936977 0.936976 O\n0.023464 0.813139 0.561323 O\n0.749999 0.063024 0.063024 O\n0.476536 0.561323 0.813138 O\n0.250000 0.754570 0.200894 O\n0.523463 0.438677 0.186862 O\n0.250000 0.200894 0.754570 O\n0.976536 0.186862 0.438677 O\n0.476536 0.813139 0.561323 O\n",
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{
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"created_at": "2022-09-04T14:38:33.024387Z",
"updated_at": "2022-09-04T14:38:33.024419Z",
"structure_string": "Zr2 Br2\n1.0\n3.465914 -0.001517 8.981925\n1.671606 3.036165 8.981925\n-0.002569 -0.001517 9.627436\nZr Br\n2 2\ndirect\n0.208202 0.208201 0.208202 Zr\n0.791800 0.791796 0.791799 Zr\n0.391372 0.391370 0.391372 Br\n0.608630 0.608627 0.608630 Br\n",
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{
"id": "jvasp-56707",
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{
"id": "jvasp-116685",
"created_at": "2022-09-04T14:38:33.017000Z",
"updated_at": "2022-09-04T14:38:33.017026Z",
"structure_string": "La6 Mg1 Si2 S14\n1.0\n10.372681 -0.000000 0.000000\n-5.186341 8.983005 0.000000\n-0.000000 -0.000000 5.768402\nLa Mg Si S\n6 1 2 14\ndirect\n0.642394 0.764808 0.754618 La\n0.122414 0.357606 0.754618 La\n0.235191 0.877585 0.754618 La\n0.357532 0.233706 0.245794 La\n0.876173 0.642467 0.245794 La\n0.766294 0.123826 0.245794 La\n0.000000 0.000000 0.510928 Mg\n0.333333 0.666666 0.171393 Si\n0.666667 0.333333 0.661610 Si\n0.524634 0.114272 0.522554 S\n0.114850 0.590791 0.029616 S\n0.409208 0.524059 0.029616 S\n0.475940 0.885149 0.029616 S\n0.837484 0.081806 0.751954 S\n0.918194 0.755677 0.751954 S\n0.755193 0.839621 0.272450 S\n0.160378 0.915571 0.272450 S\n0.084429 0.244807 0.272450 S\n0.589638 0.475365 0.522554 S\n0.666667 0.333333 0.027659 S\n0.333333 0.666666 0.536539 S\n0.244322 0.162515 0.751954 S\n0.885727 0.410362 0.522554 S\n",
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{
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"created_at": "2022-09-04T14:38:33.016389Z",
"updated_at": "2022-09-04T14:38:33.016419Z",
"structure_string": "Ta2 Tl2 Ge6 O18\n1.0\n3.549544 -6.147991 0.000000\n3.549544 6.147991 -0.000000\n-0.000000 -0.000000 10.298750\nTa Tl Ge O\n2 2 6 18\ndirect\n0.333332 0.666666 0.000000 Ta\n0.333332 0.666666 0.500000 Ta\n0.666666 0.333332 0.000000 Tl\n0.666666 0.333332 0.500000 Tl\n0.072298 0.782880 0.750000 Ge\n0.710582 0.927701 0.750000 Ge\n0.217119 0.289417 0.750000 Ge\n0.217118 0.927701 0.250000 Ge\n0.072298 0.289417 0.250000 Ge\n0.710582 0.782880 0.250000 Ge\n0.559498 0.657658 0.109582 O\n0.098159 0.657658 0.609582 O\n0.342341 0.440501 0.609582 O\n0.098159 0.657658 0.890418 O\n0.342341 0.440501 0.890418 O\n0.559498 0.901839 0.890418 O\n0.342341 0.901839 0.109582 O\n0.559498 0.657658 0.390418 O\n0.799790 0.733117 0.750000 O\n0.098160 0.440501 0.109582 O\n0.266882 0.066674 0.750000 O\n0.933325 0.200209 0.750000 O\n0.098160 0.440501 0.390418 O\n0.799790 0.066673 0.250000 O\n0.933325 0.733117 0.250000 O\n0.266882 0.200209 0.250000 O\n0.342341 0.901839 0.390418 O\n0.559498 0.901839 0.609582 O\n",
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{
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"structure_string": "V6 Co2\n1.0\n4.639548 0.000000 0.000000\n0.000000 4.639548 -0.000000\n0.000000 0.000000 4.639548\nV Co\n6 2\ndirect\n0.500000 0.250000 0.000000 V\n0.500000 0.750000 0.000000 V\n0.250000 0.000000 0.500000 V\n0.750000 0.000000 0.500000 V\n0.000000 0.500000 0.250000 V\n0.000000 0.500000 0.750000 V\n0.500000 0.500000 0.500000 Co\n0.000000 0.000000 0.000000 Co\n",
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{
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"created_at": "2022-09-04T14:38:33.011693Z",
"updated_at": "2022-09-04T14:38:33.011727Z",
"structure_string": "Li8 Mn2 Co4 O14\n1.0\n4.890890 -0.039085 -0.494761\n-1.621716 5.485941 -0.038455\n0.046966 -0.034872 8.546038\nLi Mn Co O\n8 2 4 14\ndirect\n0.429728 0.362478 0.852671 Li\n0.720160 0.929628 0.427511 Li\n0.852760 0.216438 0.705183 Li\n0.145637 0.774454 0.293134 Li\n0.277026 0.078054 0.561574 Li\n0.559641 0.635070 0.154482 Li\n0.007668 0.499321 0.004783 Li\n0.145056 0.289815 0.293256 Li\n0.000230 0.001343 0.001304 Mn\n0.574718 0.149003 0.149910 Mn\n0.429233 0.858262 0.857218 Co\n0.713687 0.426251 0.426915 Co\n0.285260 0.569662 0.569335 Co\n0.857477 0.715026 0.712840 Co\n0.720537 0.700135 0.918293 O\n0.285240 0.296450 0.066462 O\n0.565613 0.870663 0.655275 O\n0.716060 0.162678 0.936600 O\n-0.005667 0.724937 0.509272 O\n0.138730 0.015561 0.793816 O\n0.437396 0.599017 0.371875 O\n0.833062 0.446507 0.216257 O\n0.578596 0.417443 0.632675 O\n0.847148 0.969739 0.196513 O\n0.000286 0.271399 0.501609 O\n0.285050 0.840276 0.065300 O\n0.449479 0.117124 0.348133 O\n0.150194 0.563274 0.777800 O\n",
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{
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"updated_at": "2022-09-04T14:38:33.011058Z",
"structure_string": "Sr2 Ni8 Sn4\n1.0\n6.442073 0.024926 -2.230795\n-3.258519 5.557245 -2.230795\n-0.014216 -0.024926 6.817370\nSr Ni Sn\n2 8 4\ndirect\n0.750000 0.750000 -0.000001 Sr\n0.250000 0.250000 -0.000000 Sr\n0.526118 0.297777 0.499999 Ni\n0.026119 0.526119 0.228341 Ni\n0.297776 0.797776 0.771656 Ni\n0.797776 0.026119 0.499999 Ni\n0.202222 0.973880 0.499998 Ni\n0.973880 0.473881 0.771656 Ni\n0.473880 0.702222 0.499999 Ni\n0.702223 0.202223 0.228341 Ni\n0.839522 0.660477 0.499999 Sn\n0.660476 0.160477 0.820954 Sn\n0.339522 0.839522 0.179043 Sn\n0.160476 0.339522 0.499999 Sn\n",
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{
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"updated_at": "2022-09-04T14:38:33.009500Z",
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{
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"created_at": "2022-09-04T14:38:33.003780Z",
"updated_at": "2022-09-04T14:38:33.003803Z",
"structure_string": "Cr1 Cu1 O2\n1.0\n2.910564 0.005153 5.216017\n1.360792 2.572869 5.216017\n0.008537 0.005153 5.973119\nCr Cu O\n1 1 2\ndirect\n0.500000 0.500000 0.500001 Cr\n0.000000 0.000000 0.000000 Cu\n0.891761 0.891756 0.891762 O\n0.108240 0.108241 0.108240 O\n",
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}