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{
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"structure_string": "Ba1 Se1 Cl2\n1.0\n4.083224 0.000000 0.000000\n0.000000 4.083224 0.000000\n0.000000 -0.000000 7.211559\nBa Se Cl\n1 1 2\ndirect\n0.499999 0.499999 0.611658 Ba\n0.000000 0.000000 0.949800 Se\n0.000000 0.000000 0.433050 Cl\n0.499999 0.499999 0.015493 Cl\n",
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{
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"structure_string": "Ba8 I12 O2\n1.0\n5.476473 -9.485529 -0.000000\n5.476473 9.485529 0.000000\n-0.000000 -0.000000 8.462760\nBa I O\n8 12 2\ndirect\n0.406870 0.203435 0.128198 Ba\n0.203435 0.406870 0.628198 Ba\n0.203435 0.796565 0.628198 Ba\n0.796565 0.203435 0.128198 Ba\n0.796565 0.593130 0.128198 Ba\n0.593130 0.796565 0.628198 Ba\n0.666667 0.333333 0.525309 Ba\n0.333333 0.666667 0.025309 Ba\n0.467871 0.935741 0.325924 I\n0.532129 0.467871 0.825924 I\n0.935741 0.467871 0.825924 I\n0.064258 0.532129 0.325924 I\n0.467871 0.532129 0.325924 I\n0.532129 0.064258 0.825924 I\n0.136874 0.863126 0.013655 I\n0.863125 0.726251 0.513655 I\n0.863126 0.136874 0.513655 I\n0.136874 0.273748 0.013655 I\n0.273748 0.136874 0.513655 I\n0.726251 0.863125 0.013655 I\n0.666667 0.333333 0.223247 O\n0.333333 0.666667 0.723247 O\n",
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{
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"created_at": "2022-09-04T14:38:35.794753Z",
"updated_at": "2022-09-04T14:38:35.794792Z",
"structure_string": "Mg2 I4 O12\n1.0\n0.000000 5.516847 0.001270\n5.034839 0.000000 0.000000\n0.000000 -0.051257 -9.492116\nMg I O\n2 4 12\ndirect\n0.765439 0.078713 0.754657 Mg\n0.234561 0.578713 0.245344 Mg\n0.733787 0.999511 0.099897 I\n0.266213 0.499511 0.900104 I\n0.261193 0.012630 0.567750 I\n0.738807 0.512630 0.432250 I\n0.982065 0.841063 0.622835 O\n0.017935 0.341063 0.377166 O\n0.088287 0.297279 0.775521 O\n0.150342 0.361848 0.066007 O\n0.340830 0.795665 0.419642 O\n0.551192 0.309096 0.894090 O\n0.448808 0.809096 0.105910 O\n0.659170 0.295665 0.580359 O\n0.849658 0.861848 0.933993 O\n0.911713 0.797279 0.224480 O\n0.465045 0.851195 0.696764 O\n0.534955 0.351195 0.303237 O\n",
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{
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"created_at": "2022-09-04T14:38:35.803669Z",
"updated_at": "2022-09-04T14:38:35.803681Z",
"structure_string": "Mg4 Cr4 O12\n1.0\n0.000000 5.184519 -0.000239\n4.964462 0.000000 0.000000\n0.000000 -0.000568 -7.285978\nMg Cr O\n4 4 12\ndirect\n0.063662 0.986253 0.750001 Mg\n0.436338 0.486254 0.250000 Mg\n0.563662 0.513746 0.750001 Mg\n0.936338 0.013746 0.250000 Mg\n0.000000 0.500000 0.000000 Cr\n0.500000 0.000000 0.000000 Cr\n0.500000 0.000000 0.500000 Cr\n-0.000000 0.500000 0.500000 Cr\n0.189223 0.183996 0.064595 O\n0.310777 0.683996 0.935405 O\n0.689223 0.316004 0.064595 O\n0.810777 0.816004 0.935405 O\n0.189226 0.183999 0.435403 O\n0.947292 0.375209 0.750000 O\n0.447292 0.124791 0.750000 O\n0.052708 0.624791 0.250001 O\n0.689226 0.316001 0.435403 O\n0.552708 0.875209 0.250001 O\n0.310773 0.683999 0.564598 O\n0.810774 0.816001 0.564598 O\n",
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{
"id": "jvasp-117561",
"created_at": "2022-09-04T14:38:35.807535Z",
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"structure_string": "Ba1 Se1 Cl1\n1.0\n-0.000000 3.780482 3.780482\n3.780482 -0.000000 3.780482\n3.780482 3.780482 -0.000000\nBa Se Cl\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.500000 Se\n0.000000 0.000000 0.000000 Cl\n",
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{
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"created_at": "2022-09-04T14:38:35.829275Z",
"updated_at": "2022-09-04T14:38:35.829306Z",
"structure_string": "Nd4 Cu2 Te8\n1.0\n8.379052 -0.000000 0.000000\n0.000000 6.428038 0.015204\n-0.000000 0.000597 7.704012\nNd Cu Te\n4 2 8\ndirect\n0.055335 0.498487 0.231906 Nd\n0.940266 0.004405 0.759402 Nd\n0.440266 0.995595 0.240598 Nd\n0.555335 0.501514 0.768093 Nd\n0.209485 0.695748 0.585976 Cu\n0.709485 0.304253 0.414023 Cu\n0.413180 0.511056 0.381362 Te\n0.586984 0.014036 0.619898 Te\n0.086984 0.985965 0.380101 Te\n0.913179 0.488945 0.618637 Te\n0.247621 0.748020 0.919476 Te\n0.747621 0.251980 0.080523 Te\n0.749129 0.753302 0.071966 Te\n0.249129 0.246698 0.928033 Te\n",
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"structure_string": "Li1 Co6 Ge6\n1.0\n2.533805 -4.388678 -0.000000\n2.533805 4.388678 0.000000\n-0.000000 -0.000000 7.643341\nLi Co Ge\n1 6 6\ndirect\n0.000000 0.000000 0.000000 Li\n0.499999 0.499999 0.249930 Co\n-0.000001 0.500000 0.249930 Co\n0.500000 -0.000001 0.750070 Co\n0.499999 0.499999 0.750070 Co\n-0.000001 0.500000 0.750070 Co\n0.500000 -0.000001 0.249930 Co\n0.666666 0.333332 0.000000 Ge\n0.333332 0.666666 0.500000 Ge\n0.666666 0.333332 0.500000 Ge\n0.000000 0.000000 0.330749 Ge\n0.000000 0.000000 0.669251 Ge\n0.333332 0.666666 0.000000 Ge\n",
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{
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{
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"created_at": "2022-09-04T14:38:35.890766Z",
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"structure_string": "Ba1 Br1 Cl1\n1.0\n4.617157 -0.000000 2.665717\n1.539052 4.353097 2.665717\n-0.000000 -0.000000 5.331433\nBa Br Cl\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 Br\n0.500000 0.500000 0.500000 Cl\n",
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]
}