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{
"id": "jvasp-96940",
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"structure_string": "Cu2 Se4 O10\n1.0\n5.044460 0.000000 0.000000\n-2.522230 5.691921 -2.270197\n0.000000 0.001156 7.820023\nCu Se O\n2 4 10\ndirect\n0.500000 0.000000 0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.207081 0.286844 0.331117 Se\n0.920237 0.713156 0.168882 Se\n0.792919 0.713157 0.668882 Se\n0.079763 0.286844 0.831117 Se\n0.399366 0.255341 0.493703 O\n0.144025 0.744659 0.006297 O\n0.600634 0.744660 0.506297 O\n0.855975 0.255341 0.993702 O\n0.397458 0.256004 0.151974 O\n0.141454 0.743996 0.348025 O\n0.115022 0.000001 0.750000 O\n0.884979 0.000000 0.250000 O\n0.858546 0.256004 0.651974 O\n0.602542 0.743996 0.848025 O\n",
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{
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{
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"updated_at": "2022-09-04T14:37:27.992286Z",
"structure_string": "Ca2 Sb4 O8\n1.0\n6.773830 -0.393449 -0.047767\n3.046179 6.063032 -0.047767\n3.234334 1.867344 5.281645\nCa Sb O\n2 4 8\ndirect\n0.125000 0.624999 0.625000 Ca\n0.625000 0.124999 0.625000 Ca\n0.020512 0.020512 0.979488 Sb\n0.229487 0.229487 0.270513 Sb\n0.625000 0.625000 0.124999 Sb\n0.625000 0.624999 0.625000 Sb\n0.371143 0.371143 0.378843 O\n0.406319 0.843200 0.375241 O\n0.371143 0.371142 0.878871 O\n0.843201 0.406318 0.375241 O\n0.406800 0.843680 0.874759 O\n0.843681 0.406799 0.874759 O\n0.878857 0.878856 0.371129 O\n0.878857 0.878856 0.871157 O\n",
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{
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"created_at": "2022-09-04T14:38:48.788239Z",
"updated_at": "2022-09-04T14:38:48.788265Z",
"structure_string": "In4 Ge4 N8\n1.0\n5.987561 -0.000000 0.000000\n0.000000 7.185189 0.000000\n-0.000000 0.000000 5.220270\nIn Ge N\n4 4 8\ndirect\n0.597129 0.886243 0.007798 In\n0.402871 0.113757 0.507798 In\n0.902871 0.386243 0.507798 In\n0.097129 0.613757 0.007798 In\n0.526929 0.370890 0.002363 Ge\n0.473071 0.629110 0.502363 Ge\n0.973071 0.870890 0.502363 Ge\n0.026929 0.129110 0.002363 Ge\n0.529363 0.389495 0.359786 N\n0.470637 0.610505 0.859786 N\n0.970637 0.889495 0.859786 N\n0.029363 0.110505 0.359786 N\n0.721640 0.757946 0.371053 N\n0.278360 0.242054 0.871053 N\n0.778360 0.257946 0.871053 N\n0.221640 0.742054 0.371053 N\n",
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{
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"created_at": "2022-09-04T14:38:13.898199Z",
"updated_at": "2022-09-04T14:38:13.898226Z",
"structure_string": "Sn4 Se4\n1.0\n4.519690 -0.000000 0.000000\n0.000000 4.217948 0.000000\n0.000000 -0.000000 11.780968\nSn Se\n4 4\ndirect\n0.612322 0.250000 0.379110 Sn\n0.112322 0.750000 0.120890 Sn\n0.387678 0.750000 0.620890 Sn\n0.887678 0.250000 0.879111 Sn\n0.472805 0.750000 0.855674 Se\n0.027195 0.750000 0.355674 Se\n-0.027195 0.250000 0.644326 Se\n0.527195 0.250000 0.144326 Se\n",
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{
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"created_at": "2022-09-04T14:36:57.378421Z",
"updated_at": "2022-09-04T14:36:57.378436Z",
"structure_string": "Dy4 Ga4 O12\n1.0\n5.284080 0.000000 0.000000\n0.000000 5.593996 0.000000\n0.000000 0.000000 7.598511\nDy Ga O\n4 4 12\ndirect\n0.019211 0.069462 0.990925 Dy\n0.480789 0.569463 0.990925 Dy\n0.519211 0.430538 0.490925 Dy\n0.980789 0.930538 0.490925 Dy\n0.000000 0.499998 0.240926 Ga\n0.500000 -0.000003 0.240926 Ga\n0.500000 0.000003 0.740926 Ga\n-0.000000 0.500003 0.740926 Ga\n0.806680 0.195579 0.296826 O\n0.693320 0.695580 0.296826 O\n0.693318 0.695580 0.685026 O\n0.609829 0.963332 0.990926 O\n0.390171 0.036668 0.490926 O\n0.193318 0.804421 0.185026 O\n0.306680 0.304421 0.796826 O\n0.193320 0.804422 0.796826 O\n0.806682 0.195580 0.685026 O\n0.109829 0.536669 0.490926 O\n0.306682 0.304420 0.185026 O\n0.890171 0.463332 0.990926 O\n",
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{
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"created_at": "2022-09-04T14:36:44.367614Z",
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"structure_string": "Dy4 Co4 I2\n1.0\n3.925791 0.000000 -0.000000\n-1.962896 3.399835 0.000000\n0.000000 -0.000000 16.828939\nDy Co I\n4 4 2\ndirect\n0.000000 0.000000 0.103726 Dy\n0.000000 0.000000 0.896274 Dy\n0.000000 0.000000 0.603726 Dy\n0.000000 0.000000 0.396274 Dy\n0.333333 0.666668 0.501659 Co\n0.666667 0.333333 0.498341 Co\n0.666667 0.333333 0.001659 Co\n0.333333 0.666668 0.998342 Co\n0.333333 0.666668 0.250000 I\n0.666667 0.333333 0.750000 I\n",
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{
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"structure_string": "Hf6 N4 O6\n1.0\n-3.996384 -0.008639 0.000440\n1.986560 5.297025 0.004545\n-0.001158 -0.112820 -10.619603\nHf N O\n6 4 6\ndirect\n0.816392 0.633413 0.751208 Hf\n0.855808 0.712236 0.059367 Hf\n0.863389 0.727446 0.444174 Hf\n0.191977 0.384568 0.250631 Hf\n0.143043 0.286681 0.944119 Hf\n0.137196 0.275011 0.559959 Hf\n0.700331 0.401267 0.920680 N\n0.953718 0.908246 0.615447 N\n0.296031 0.592723 0.425275 N\n0.299448 0.599513 0.080339 N\n0.689837 0.380301 0.580120 O\n0.751474 0.503575 0.248183 O\n0.954766 0.910095 0.887507 O\n0.246470 0.493559 0.742443 O\n0.044242 0.089121 0.115241 O\n0.042549 0.085575 0.379653 O\n",
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"structure_string": "Cl4 O12\n1.0\n5.013635 0.007302 -0.524800\n-2.125987 4.540570 -0.524800\n-0.016575 -0.026105 9.866721\nCl O\n4 12\ndirect\n0.817630 0.682621 0.139048 Cl\n0.682620 0.817629 0.639048 Cl\n0.181546 0.313808 0.377429 Cl\n0.313808 0.181546 0.877429 Cl\n0.580391 0.452240 0.184733 O\n0.452239 0.580390 0.684733 O\n0.818825 0.972501 0.186325 O\n0.972501 0.818824 0.686325 O\n0.377135 0.970943 0.944919 O\n0.970944 0.377136 0.444919 O\n0.112148 0.281914 0.932055 O\n0.281914 0.112149 0.432056 O\n0.635696 0.766490 0.486827 O\n0.766490 0.635695 0.986827 O\n0.690507 0.099394 0.690261 O\n0.099395 0.690508 0.190261 O\n",
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{
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"structure_string": "Mn6 O2 F10\n1.0\n4.816929 0.108846 -0.000000\n0.108846 4.816929 0.000000\n0.000000 -0.000000 9.686408\nMn O F\n6 2 10\ndirect\n0.015724 0.984277 0.011490 Mn\n0.016253 0.983749 0.333333 Mn\n0.015724 0.984277 0.655177 Mn\n0.514295 0.485706 0.833333 Mn\n0.478961 0.521040 0.169746 Mn\n0.478961 0.521040 0.496921 Mn\n0.189040 0.810961 0.175618 O\n0.189040 0.810961 0.491049 O\n0.791359 0.208642 0.178477 F\n0.698649 0.694112 0.665050 F\n0.687143 0.705162 0.333333 F\n0.698649 0.694112 0.001617 F\n0.204130 0.795871 0.833333 F\n0.294839 0.312858 0.333333 F\n0.305889 0.301352 0.001617 F\n0.791359 0.208642 0.488191 F\n0.305889 0.301352 0.665050 F\n0.824107 0.175894 0.833333 F\n",
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{
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"updated_at": "2022-09-04T14:38:16.366860Z",
"structure_string": "Mg2 Fe2 Ge4 O12\n1.0\n5.091518 -0.248802 0.869760\n0.986275 6.539438 0.651797\n-0.355296 0.004608 6.635930\nMg Fe Ge O\n2 2 4 12\ndirect\n0.750000 0.272324 0.727677 Mg\n0.250001 0.727677 0.272324 Mg\n0.750001 0.918898 0.081102 Fe\n0.249999 0.081103 0.918898 Fe\n0.787609 0.402282 0.204263 Ge\n0.712392 0.795738 0.597719 Ge\n0.212391 0.597719 0.795737 Ge\n0.287609 0.204263 0.402281 Ge\n0.636136 0.975699 0.783401 O\n0.863865 0.216600 0.024302 O\n0.613710 0.634498 0.137785 O\n0.886292 0.862216 0.365502 O\n0.386291 0.365503 0.862215 O\n0.897263 0.565922 0.706426 O\n0.102738 0.434079 0.293575 O\n0.397263 0.706426 0.565921 O\n0.136135 0.783401 0.975698 O\n0.602738 0.293575 0.434079 O\n0.113709 0.137785 0.634498 O\n0.363865 0.024302 0.216599 O\n",
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]
}