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{
"id": "jvasp-33840",
"created_at": "2022-09-04T14:38:04.997361Z",
"updated_at": "2022-09-04T14:38:04.997379Z",
"structure_string": "Tc4 Br12\n1.0\n11.283954 0.000000 0.000000\n0.000000 5.923411 0.000000\n0.000000 -0.000000 6.531657\nTc Br\n4 12\ndirect\n0.250000 0.030185 0.238939 Tc\n0.250000 0.469815 0.238939 Tc\n0.750000 0.530185 0.761062 Tc\n0.750000 0.969815 0.761062 Tc\n0.750000 0.749999 0.093687 Br\n0.099499 0.749999 0.088807 Br\n0.400500 0.749999 0.088807 Br\n0.082531 0.249999 0.403708 Br\n0.417469 0.249999 0.403708 Br\n0.750000 0.249999 0.460252 Br\n0.250000 0.749999 0.539748 Br\n0.582531 0.749999 0.596291 Br\n0.917468 0.749999 0.596291 Br\n0.599499 0.249999 0.911195 Br\n0.900500 0.249999 0.911195 Br\n0.250000 0.249999 0.906314 Br\n",
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{
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"structure_string": "Si2 Ni2\n1.0\n3.092850 0.000000 0.000000\n0.000000 3.275932 0.000000\n0.000000 0.000000 4.714908\nSi Ni\n2 2\ndirect\n0.000000 0.000000 0.840148 Si\n0.500000 0.500000 0.159853 Si\n0.000000 0.000000 0.340509 Ni\n0.500000 0.500000 0.659491 Ni\n",
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{
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"structure_string": "H26 C8 N2 F4\n1.0\n5.250422 0.000000 0.000000\n0.000000 6.403100 0.000000\n0.000000 0.000000 8.578212\nH C N F\n26 8 2 4\ndirect\n0.987897 0.750000 0.005255 H\n0.742673 0.891487 0.392184 H\n0.633642 0.250000 0.250000 H\n0.742673 0.891487 0.107816 H\n0.257327 0.108513 0.607816 H\n0.742673 0.608513 0.392184 H\n0.257327 0.391487 0.892184 H\n0.742673 0.608513 0.107816 H\n0.987897 0.750000 0.494745 H\n0.691261 0.439540 0.644725 H\n0.065381 0.078079 0.250000 H\n0.012102 0.250000 0.994745 H\n0.308739 0.939540 0.355275 H\n0.308739 0.939540 0.144725 H\n0.366358 0.750000 0.750000 H\n0.691261 0.060460 0.855275 H\n0.691261 0.060460 0.644725 H\n0.934619 0.921921 0.750000 H\n0.012102 0.250000 0.505254 H\n0.691261 0.439540 0.855275 H\n0.065381 0.421921 0.250000 H\n0.308739 0.560460 0.355275 H\n0.934619 0.578079 0.750000 H\n0.257327 0.391487 0.607816 H\n0.257327 0.108513 0.892184 H\n0.308739 0.560460 0.144725 H\n0.139526 0.250000 0.606612 C\n0.809465 0.441071 0.750000 C\n0.860474 0.750000 0.393388 C\n0.809465 0.058929 0.750000 C\n0.860474 0.750000 0.106612 C\n0.190535 0.941071 0.250000 C\n0.139526 0.250000 0.893388 C\n0.190535 0.558929 0.250000 C\n0.974984 0.250000 0.750000 N\n0.025016 0.750000 0.250000 N\n0.362704 0.750000 0.884539 F\n0.362704 0.750000 0.615461 F\n0.637295 0.250000 0.115461 F\n0.637295 0.250000 0.384539 F\n",
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{
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"created_at": "2022-09-04T14:38:06.987945Z",
"updated_at": "2022-09-04T14:38:06.987973Z",
"structure_string": "Cr2 O2 F2\n1.0\n3.865640 -0.000000 0.000000\n0.000000 2.794117 0.000000\n0.000000 0.000000 5.711944\nCr O F\n2 2 2\ndirect\n0.250000 0.250000 0.117464 Cr\n0.750000 0.750001 0.882535 Cr\n0.250000 0.750001 0.874918 O\n0.750000 0.250000 0.125081 O\n0.250000 0.750001 0.353609 F\n0.750000 0.250000 0.646390 F\n",
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{
"id": "jvasp-12713",
"created_at": "2022-09-04T14:38:10.003649Z",
"updated_at": "2022-09-04T14:38:10.003682Z",
"structure_string": "V4 O10\n1.0\n3.563976 0.000000 0.000000\n0.000000 4.287188 0.000000\n0.000000 0.000000 11.738548\nV O\n4 10\ndirect\n0.000000 0.110611 0.147823 V\n0.500001 0.889390 0.352177 V\n0.500001 0.889390 0.647823 V\n0.000000 0.110611 0.852178 V\n0.500001 0.004018 0.181811 O\n0.000000 -0.004018 0.318189 O\n0.000000 -0.004018 0.681811 O\n0.500001 0.004018 0.818189 O\n0.000000 0.486332 0.853878 O\n0.500001 0.513669 0.646123 O\n0.500001 0.513669 0.353877 O\n0.500001 -0.007476 0.500000 O\n0.000000 0.007476 0.000000 O\n0.000000 0.486332 0.146123 O\n",
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{
"id": "jvasp-88839",
"created_at": "2022-09-04T14:38:12.052681Z",
"updated_at": "2022-09-04T14:38:12.052706Z",
"structure_string": "Sr4 Cd2 W2 O12\n1.0\n5.813143 0.000000 0.000000\n0.000000 5.956277 0.000000\n0.000000 0.000000 8.268612\nSr Cd W O\n4 2 2 12\ndirect\n0.000000 0.511715 0.256893 Sr\n0.000000 0.511715 0.743107 Sr\n0.500000 0.950287 0.243107 Sr\n0.500000 0.950287 0.756893 Sr\n0.500000 0.464848 0.000000 Cd\n0.000000 -0.002849 0.500000 Cd\n0.000000 0.974363 0.000000 W\n0.500000 0.487636 0.500000 W\n0.232474 0.736877 0.000000 O\n0.767526 0.736877 0.000000 O\n0.500000 0.506072 0.732624 O\n0.261182 0.269161 0.500000 O\n0.738818 0.269161 0.500000 O\n0.267526 0.725123 0.500000 O\n0.732473 0.725123 0.500000 O\n0.000000 0.955930 0.232627 O\n0.000000 0.955930 0.767373 O\n0.500000 0.506072 0.267376 O\n0.238821 0.192838 0.000000 O\n0.761179 0.192838 0.000000 O\n",
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"formula_full": "Sr4 Cd2 W2 O12",
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{
"id": "jvasp-53297",
"created_at": "2022-09-04T14:38:12.619471Z",
"updated_at": "2022-09-04T14:38:12.619492Z",
"structure_string": "Ni6 Sb2\n1.0\n4.285364 0.000000 0.000000\n0.000000 4.545163 0.000000\n0.000000 0.000000 5.346694\nNi Sb\n6 2\ndirect\n0.000000 0.686296 0.500000 Ni\n0.500000 0.313703 0.000000 Ni\n0.000000 0.172205 0.749834 Ni\n0.500000 0.827794 0.750165 Ni\n0.000000 0.172205 0.250165 Ni\n0.500000 0.827794 0.249834 Ni\n0.500000 0.321388 0.500000 Sb\n0.000000 0.678611 0.000000 Sb\n",
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{
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"created_at": "2022-09-04T14:38:12.912984Z",
"updated_at": "2022-09-04T14:38:12.913007Z",
"structure_string": "Lu2 S2 Br2\n1.0\n5.262178 0.000000 0.000000\n0.000000 3.943033 0.000000\n0.000000 0.000000 7.990013\nLu S Br\n2 2 2\ndirect\n0.750000 0.750000 0.636589 Lu\n0.250000 0.250000 0.363411 Lu\n0.750000 0.250000 0.408556 S\n0.250000 0.750000 0.591444 S\n0.250000 0.750000 0.123763 Br\n0.750000 0.250000 0.876237 Br\n",
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{
"id": "jvasp-30189",
"created_at": "2022-09-04T14:38:13.180021Z",
"updated_at": "2022-09-04T14:38:13.180043Z",
"structure_string": "Tm2 Br2 O2\n1.0\n4.104770 0.000000 0.000000\n0.000000 3.765780 0.000000\n0.000000 0.000000 8.919378\nTm Br O\n2 2 2\ndirect\n0.250000 0.250000 0.114441 Tm\n0.750000 0.750000 0.885559 Tm\n0.250000 0.750000 0.344196 Br\n0.750000 0.250000 0.655804 Br\n0.250000 0.750000 0.973451 O\n0.750000 0.250000 0.026549 O\n",
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{
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"structure_string": "Ca2 C2 O6\n1.0\n4.319036 0.000000 0.000000\n0.000000 4.962645 0.000000\n0.000000 0.000000 4.947644\nCa C O\n2 2 6\ndirect\n0.604681 0.500000 0.000000 Ca\n0.395320 0.000000 0.500000 Ca\n0.989365 0.000000 0.000000 C\n0.010636 0.500000 0.500000 C\n0.131713 0.227773 0.000000 O\n0.131713 0.772228 0.000000 O\n0.313642 0.500000 0.500000 O\n0.686358 0.000000 0.000000 O\n0.868288 0.272227 0.500000 O\n0.868288 0.727774 0.500000 O\n",
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{
"id": "jvasp-9860",
"created_at": "2022-09-04T14:38:13.856779Z",
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"structure_string": "Zn2 Mo4 O10\n1.0\n3.812866 0.002066 0.000496\n-0.004715 6.871586 0.001211\n-0.000607 -0.002137 11.421099\nZn Mo O\n2 4 10\ndirect\n0.751045 0.863394 0.249450 Zn\n0.252901 0.136918 0.749446 Zn\n0.251692 0.371140 0.086211 Mo\n0.751775 0.629170 0.912607 Mo\n0.751740 0.629176 0.586215 Mo\n0.251724 0.371149 0.412603 Mo\n0.751756 0.610487 0.749410 O\n0.251705 0.389833 0.249408 O\n0.751719 0.465653 0.064870 O\n0.251739 0.534659 0.933948 O\n0.751741 0.465659 0.433952 O\n0.251720 0.534664 0.564868 O\n0.251666 0.132806 0.442285 O\n0.751801 0.867519 0.556532 O\n0.751784 0.867506 0.942314 O\n0.251682 0.132805 0.056505 O\n",
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{
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"structure_string": "Mg4 Sn8 O16\n1.0\n6.970145 -0.000105 -0.000001\n-0.000094 6.141812 -0.000002\n0.000028 0.000029 11.169373\nMg Sn O\n4 8 16\ndirect\n0.935038 0.249996 0.749999 Mg\n0.064962 0.750002 0.249998 Mg\n0.234505 0.250007 0.249994 Mg\n0.765495 0.749991 0.749995 Mg\n0.999889 0.499999 0.000014 Sn\n0.000109 -0.000001 0.500014 Sn\n0.000109 0.500001 0.500015 Sn\n0.999890 0.000001 0.000014 Sn\n0.597980 0.249987 0.549749 Sn\n0.402022 0.750010 0.049746 Sn\n0.402212 0.750010 0.450191 Sn\n0.597788 0.249988 0.950193 Sn\n0.782041 0.495276 0.632291 O\n0.217962 0.995289 0.132290 O\n0.218126 0.504712 0.367707 O\n0.217961 0.504724 0.132290 O\n0.218127 0.995300 0.367707 O\n0.781873 0.004700 0.867708 O\n0.834863 0.249993 0.079020 O\n0.885457 0.749996 0.102477 O\n0.164886 0.750006 0.920975 O\n0.165140 0.750005 0.579018 O\n0.114375 0.250005 0.897569 O\n0.114543 0.250004 0.602476 O\n0.782040 0.004708 0.632291 O\n0.885626 0.749994 0.397571 O\n0.835113 0.249993 0.420978 O\n0.781872 0.495285 0.867709 O\n",
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}
]
}