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{
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"updated_at": "2022-09-04T14:35:42.955270Z",
"structure_string": "Ca1 B2 H10 N2\n1.0\n2.132107 4.557572 0.013859\n-2.132107 4.557572 0.013859\n0.000000 0.378571 6.328609\nCa B H N\n1 2 10 2\ndirect\n0.600110 0.399889 0.000000 Ca\n0.256644 0.085991 0.784243 B\n0.914008 0.743355 0.215758 B\n0.007884 0.144694 0.696331 H\n0.855306 -0.007885 0.303669 H\n0.212318 0.485795 0.257484 H\n0.514205 0.787681 0.742516 H\n0.199586 0.093455 0.979658 H\n0.906544 0.800414 0.020342 H\n0.476161 0.255030 0.578294 H\n0.744970 0.523839 0.421706 H\n0.419583 0.891094 0.316210 H\n0.108906 0.580417 0.683791 H\n0.330713 0.332943 0.716280 N\n0.667056 0.669286 0.283721 N\n",
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{
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"structure_string": "Ca1 B2 As1\n1.0\n0.000000 3.177331 3.177331\n3.177331 0.000000 3.177331\n3.177331 3.177331 0.000000\nCa B As\n1 2 1\ndirect\n0.750000 0.750000 0.750000 Ca\n0.000000 0.000000 0.000000 B\n0.250000 0.250000 0.250000 B\n0.500000 0.500000 0.500000 As\n",
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"structure_string": "Ca1 B2\n1.0\n1.607583 -2.784416 -0.000000\n1.607583 2.784416 -0.000000\n-0.000000 0.000000 4.071223\nCa B\n1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333332 0.666666 0.500000 B\n0.666666 0.333332 0.500000 B\n",
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{
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{
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}