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{
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{
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{
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"structure_string": "Nd2 P10\n1.0\n0.000000 5.024538 0.033894\n9.640113 0.000000 0.000000\n0.000000 -1.170172 -5.369634\nNd P\n2 10\ndirect\n0.985106 0.250000 0.648308 Nd\n0.014895 0.750000 0.351692 Nd\n0.714037 0.250000 0.097148 P\n0.285963 0.750000 0.902852 P\n0.382668 0.409460 0.044421 P\n0.617333 0.909460 0.955579 P\n0.617333 0.590539 0.955579 P\n0.382668 0.090540 0.044421 P\n0.290563 0.467879 0.400917 P\n0.709438 0.967879 0.599083 P\n0.709438 0.532121 0.599083 P\n0.290563 0.032121 0.400917 P\n",
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"updated_at": "2022-09-04T14:38:29.279011Z",
"structure_string": "Li6 Cr2 Si2 B2 O14\n1.0\n0.000000 5.054238 0.047184\n6.243640 0.000000 0.000000\n0.000000 -0.782266 -8.237056\nLi Cr Si B O\n6 2 2 2 14\ndirect\n0.234594 0.750000 0.102463 Li\n0.740214 0.002810 0.246457 Li\n0.740214 0.497190 0.246457 Li\n0.259786 0.502810 0.753544 Li\n0.259786 0.997190 0.753544 Li\n0.765406 0.250000 0.897538 Li\n0.202429 0.250000 0.314326 Cr\n0.797571 0.750000 0.685675 Cr\n0.727209 0.250000 0.572587 Si\n0.272791 0.750000 0.427414 Si\n0.295584 0.250000 0.034770 B\n0.704416 0.750000 0.965231 B\n0.516573 0.750000 0.826456 O\n0.817737 0.051131 0.697160 O\n0.817737 0.448869 0.697160 O\n0.403438 0.250000 0.522474 O\n0.128651 0.750000 0.594056 O\n0.871349 0.250000 0.405945 O\n0.631705 0.750000 0.117142 O\n0.182263 0.551131 0.302841 O\n0.182263 0.948869 0.302841 O\n0.483426 0.250000 0.173545 O\n0.037481 0.250000 0.081352 O\n0.962519 0.750000 0.918649 O\n0.596561 0.750000 0.477527 O\n0.368295 0.250000 0.882859 O\n",
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"structure_string": "Ti1 H16 C9 O4\n1.0\n4.706888 -0.071241 -0.974972\n-1.248160 7.130635 0.100103\n-0.130413 0.227777 7.780105\nTi H C O\n1 16 9 4\ndirect\n0.817750 0.266369 0.245368 Ti\n0.861760 0.406964 0.823676 H\n0.112391 0.345599 0.708449 H\n0.198413 0.723074 0.896799 H\n0.027353 0.681446 0.674100 H\n0.614472 0.593635 0.285006 H\n0.665754 0.718569 0.842456 H\n0.525973 0.562338 0.663907 H\n-0.034022 0.576984 0.418103 H\n0.333583 0.802439 0.471118 H\n0.709305 0.874248 0.550888 H\n0.325217 -0.004955 0.110237 H\n0.643133 0.107130 0.742838 H\n0.269437 0.009565 0.726423 H\n0.629764 0.903322 0.239699 H\n0.930532 0.644732 0.189730 H\n0.635032 0.981940 0.019238 H\n0.090943 0.429911 0.817314 C\n0.195050 0.639812 0.781180 C\n0.488212 0.686723 0.725870 C\n0.499537 0.847600 0.590578 C\n0.254351 0.358511 0.987867 C\n0.362924 0.157203 0.497157 C\n0.825784 0.557293 0.285235 C\n0.561691 0.006979 0.138940 C\n0.445965 0.034477 0.654930 C\n0.518804 0.352551 0.011746 O\n0.553147 0.236427 0.415821 O\n0.106291 0.303699 0.108490 O\n0.094035 0.171476 0.449024 O\n",
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{
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"structure_string": "Ba4 Sc1 Ga1\n1.0\n-0.000000 5.063743 5.063743\n5.063743 -0.000000 5.063743\n5.063743 5.063743 -0.000000\nBa Sc Ga\n4 1 1\ndirect\n0.126556 0.624481 0.624481 Ba\n0.624481 0.624481 0.624481 Ba\n0.624481 0.126556 0.624481 Ba\n0.624481 0.624481 0.126556 Ba\n0.000000 0.000000 0.000000 Sc\n0.250000 0.250000 0.250000 Ga\n",
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"structure_string": "Li2 P4 W2 O14\n1.0\n6.469583 -0.048375 -0.000913\n0.951253 6.414168 0.012728\n0.801588 2.621125 6.254191\nLi P W O\n2 4 2 14\ndirect\n0.981487 0.301442 0.174947 Li\n0.018512 0.698558 0.825054 Li\n0.864368 0.778588 0.237905 P\n0.605720 0.646690 0.657608 P\n0.394280 0.353310 0.342393 P\n0.135631 0.221412 0.762095 P\n0.653677 0.094087 0.775099 W\n0.346322 0.905913 0.224901 W\n0.228679 0.376973 0.532187 O\n0.288502 0.224459 0.243579 O\n0.328346 0.057717 0.878046 O\n0.415144 0.595986 0.190312 O\n0.401985 0.772707 0.554220 O\n0.598014 0.227293 0.445780 O\n0.771320 0.623027 0.467814 O\n0.671653 0.942283 0.121955 O\n0.711498 0.775541 0.756421 O\n0.039914 0.376928 0.868981 O\n0.960085 0.623073 0.131020 O\n0.985393 0.072476 0.732695 O\n0.584856 0.404014 0.809688 O\n0.014606 0.927524 0.267306 O\n",
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}