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{
"id": "jvasp-113966",
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"structure_string": "Li1 B1 C1\n1.0\n2.213912 -0.000000 -0.000000\n-0.000000 2.213912 -0.000000\n-0.000000 -0.000000 5.429900\nLi B C\n1 1 1\ndirect\n0.000000 0.000000 0.001335 Li\n0.000000 0.000000 0.375095 B\n0.000000 0.000000 0.652091 C\n",
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{
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{
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"created_at": "2022-09-04T14:35:47.784534Z",
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"structure_string": "Li1 Cr1 O2\n1.0\n2.782144 -0.020142 4.209081\n1.250383 2.485412 4.209081\n-0.032946 -0.020142 5.045355\nLi Cr O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.499998 0.500000 0.500001 Cr\n0.241956 0.241957 0.241957 O\n0.758040 0.758044 0.758044 O\n",
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{
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"structure_string": "Cd1 H6 C5 O4\n1.0\n4.011138 0.110778 0.360957\n1.301356 4.211132 1.200960\n0.069904 0.057487 8.500145\nCd H C O\n1 6 5 4\ndirect\n0.411619 0.274136 0.761799 Cd\n0.787485 0.009418 0.278486 H\n0.203478 0.787918 0.368857 H\n0.667891 0.496609 0.299247 H\n0.394023 0.457846 0.136702 H\n0.078890 0.280475 0.390725 H\n0.111223 0.263292 0.106087 H\n0.769064 0.778597 0.531833 C\n0.933126 0.784211 0.362093 C\n0.938390 0.498770 0.301001 C\n0.113776 0.483960 0.134494 C\n0.964885 0.754314 0.985404 C\n0.851161 0.508461 0.643238 O\n0.555008 0.038080 0.553270 O\n0.672762 0.971255 -0.001541 O\n0.139725 0.755202 0.851341 O\n",
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{
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"structure_string": "C16\n1.0\n4.268256 0.000000 0.000000\n-0.000000 4.931122 0.000000\n0.000000 0.000000 6.747984\nC\n16\ndirect\n0.166694 0.624999 0.750068 C\n0.166693 0.375000 0.249931 C\n0.333307 0.124999 0.249931 C\n0.833307 0.375000 0.249931 C\n0.833307 0.124999 0.750068 C\n0.666694 0.125000 0.249931 C\n0.666694 0.624999 0.249931 C\n0.666694 0.375000 0.750068 C\n0.333307 0.624999 0.249931 C\n0.833307 0.875000 0.249931 C\n0.166694 0.875000 0.249931 C\n0.666694 0.875000 0.750068 C\n0.333307 0.375000 0.750068 C\n0.166693 0.125000 0.750068 C\n0.333307 0.875000 0.750068 C\n0.833307 0.624999 0.750068 C\n",
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"structure_string": "Ca2 B4 H16\n1.0\n6.681793 0.000000 0.000000\n-0.000000 6.681793 0.000000\n0.000000 0.000000 4.374157\nCa B H\n2 4 16\ndirect\n0.500000 -0.000000 0.022547 Ca\n0.000000 0.500000 0.522547 Ca\n0.684786 0.220521 0.522545 B\n0.315214 0.779478 0.522545 B\n0.220521 0.315214 0.022545 B\n0.779478 0.684786 0.022545 B\n0.489779 0.833908 0.522554 H\n0.510220 0.166092 0.522554 H\n0.841004 0.774324 0.249709 H\n0.158995 0.225675 0.249709 H\n0.225675 0.841004 0.749709 H\n0.774324 0.158995 0.749709 H\n0.840956 0.774297 0.795331 H\n0.774297 0.159043 0.295331 H\n0.225703 0.840956 0.295331 H\n0.166092 0.489779 0.022554 H\n0.597080 0.673651 0.022589 H\n0.402919 0.326348 0.022589 H\n0.326348 0.597080 0.522589 H\n0.673651 0.402919 0.522589 H\n0.159043 0.225703 0.795331 H\n0.833908 0.510220 0.022554 H\n",
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"structure_string": "Li2 Ni3 O3 F2\n1.0\n2.920377 0.077164 -10.555789\n0.020481 2.921325 -10.555789\n-0.075681 -0.077164 10.952057\nLi Ni O F\n2 3 3 2\ndirect\n0.701611 0.701608 -0.000002 Li\n0.298390 0.298389 -0.000001 Li\n0.899978 0.899975 -0.000002 Ni\n0.500000 0.499998 -0.000001 Ni\n0.100023 0.100022 -0.000000 Ni\n0.399163 0.399161 -0.000001 O\n0.000000 0.000000 0.000000 O\n0.600838 0.600836 -0.000002 O\n0.204769 0.204769 -0.000001 F\n0.795231 0.795228 -0.000002 F\n",
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}