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"structure_string": "Sm4 Se6 O18\n1.0\n6.779462 -0.063310 -1.749393\n-3.859098 6.823978 -0.840974\n0.008520 0.102069 9.050921\nSm Se O\n4 6 18\ndirect\n0.022075 0.650605 0.319445 Sm\n0.977924 0.349395 0.680556 Sm\n0.464082 0.683226 0.129506 Sm\n0.535918 0.316775 0.870494 Sm\n0.647868 0.772184 0.516658 Se\n0.964919 0.775617 0.957211 Se\n0.624428 0.168311 0.256635 Se\n0.035081 0.224384 0.042790 Se\n0.375572 0.831690 0.743365 Se\n0.352132 0.227816 0.483343 Se\n0.239607 0.337607 0.948507 O\n0.137835 0.432722 0.186571 O\n0.872041 0.330592 0.409034 O\n0.652374 0.338946 0.144296 O\n0.181928 0.784080 0.103393 O\n0.285296 0.322750 0.635654 O\n0.852178 0.006590 0.599338 O\n0.862164 0.567278 0.813429 O\n0.434447 0.794734 0.384618 O\n0.760393 0.662394 0.051494 O\n0.347626 0.661055 0.855704 O\n0.818071 0.215921 0.896607 O\n0.147822 0.993411 0.400663 O\n0.565553 0.205266 0.615382 O\n0.700144 0.020750 0.162322 O\n0.299856 0.979250 0.837678 O\n0.127958 0.669408 0.590967 O\n0.714704 0.677251 0.364347 O\n",
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{
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"structure_string": "Cu4 As8 O16\n1.0\n5.630022 -0.000000 0.000000\n-0.000000 8.667637 0.000000\n0.000000 -0.000000 8.667637\nCu As O\n4 8 16\ndirect\n0.250000 0.500000 0.000000 Cu\n0.750000 0.000000 0.500000 Cu\n0.750000 0.500000 0.000000 Cu\n0.250000 0.000000 0.500000 Cu\n0.500000 0.341108 0.300168 As\n0.000000 0.300168 0.658892 As\n0.000000 0.699833 0.341108 As\n0.000000 0.199832 0.158892 As\n0.500000 0.841108 0.199832 As\n0.500000 0.158892 0.800168 As\n0.000000 0.800168 0.841108 As\n0.500000 0.658892 0.699833 As\n0.250000 0.298678 0.798678 O\n0.750000 0.201322 0.298678 O\n0.500000 0.874244 0.404924 O\n0.750000 0.298678 0.798678 O\n0.250000 0.201322 0.298678 O\n0.250000 0.798678 0.701322 O\n0.750000 0.701322 0.201322 O\n0.000000 0.095076 0.625757 O\n0.500000 0.374244 0.095076 O\n0.500000 0.625757 0.904924 O\n0.000000 0.904924 0.374244 O\n0.000000 0.595076 0.874244 O\n0.000000 0.404924 0.125756 O\n0.500000 0.125756 0.595076 O\n0.250000 0.701322 0.201322 O\n0.750000 0.798678 0.701322 O\n",
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{
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"updated_at": "2022-09-04T14:36:00.999025Z",
"structure_string": "Ba8 Sn4 S16\n1.0\n8.122023 0.000000 -2.722271\n0.000000 8.571933 0.000000\n-0.159548 0.000000 11.817070\nBa Sn S\n8 4 16\ndirect\n0.307417 0.804369 0.350063 Ba\n0.192583 0.304369 0.149937 Ba\n0.692583 0.195630 0.649937 Ba\n0.807416 0.695630 0.850063 Ba\n0.737533 0.874671 0.164399 Ba\n0.762467 0.374671 0.335601 Ba\n0.262467 0.125329 0.835601 Ba\n0.237533 0.625329 0.664399 Ba\n0.308866 0.686897 0.008707 Sn\n0.191133 0.186898 0.491293 Sn\n0.691133 0.313102 0.991293 Sn\n0.808866 0.813102 0.508707 Sn\n0.024572 0.307768 0.598955 S\n0.475427 0.807768 0.901045 S\n0.642730 0.614554 0.555102 S\n0.857270 0.114554 0.944898 S\n0.357270 0.385446 0.444898 S\n0.142730 0.885446 0.055102 S\n0.476048 0.600013 0.206254 S\n0.133984 0.481313 0.890193 S\n0.523951 0.399986 0.793746 S\n0.976048 0.899986 0.706254 S\n0.866016 0.518686 0.109807 S\n0.633984 0.018686 0.390194 S\n0.524572 0.192231 0.098955 S\n0.366016 0.981313 0.609806 S\n0.023951 0.100014 0.293746 S\n0.975427 0.692231 0.401045 S\n",
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"structure_string": "K4 Ba4 P4 S16\n1.0\n6.695719 -0.000000 0.000000\n0.000000 9.907851 0.000000\n0.000000 0.000000 11.697611\nK Ba P S\n4 4 4 16\ndirect\n0.250000 0.333820 0.108642 K\n0.750000 0.666180 0.891358 K\n0.750000 0.833820 0.391358 K\n0.250000 0.166180 0.608642 K\n0.250000 0.887723 0.144696 Ba\n0.750000 0.387723 0.355304 Ba\n0.250000 0.612276 0.644696 Ba\n0.750000 0.112277 0.855304 Ba\n0.750000 0.103033 0.182133 P\n0.250000 0.603033 0.317867 P\n0.750000 0.396967 0.682133 P\n0.250000 0.896967 0.817867 P\n0.250000 0.427423 0.414805 S\n0.498792 0.607990 0.215301 S\n0.998792 0.392010 0.784699 S\n0.501208 0.107990 0.284699 S\n0.501208 0.392010 0.784699 S\n0.250000 0.072577 0.914805 S\n0.001208 0.607990 0.215301 S\n0.998792 0.107990 0.284699 S\n0.250000 0.722932 0.915580 S\n0.750000 0.277068 0.084420 S\n0.001208 0.892010 0.715301 S\n0.250000 0.777068 0.415580 S\n0.750000 0.572577 0.585195 S\n0.750000 0.927423 0.085195 S\n0.498792 0.892010 0.715301 S\n0.750000 0.222932 0.584420 S\n",
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"structure_string": "Sc4 Se6 O18\n1.0\n8.095862 -0.000000 -0.000000\n-4.047931 7.011222 0.000000\n-0.000000 -0.000000 7.702280\nSc Se O\n4 6 18\ndirect\n0.333333 0.666667 0.454534 Sc\n0.666667 0.333333 0.954534 Sc\n0.666667 0.333333 0.545466 Sc\n0.333333 0.666667 0.045466 Sc\n0.705098 0.967054 0.750000 Se\n0.967054 0.261956 0.250000 Se\n0.032946 0.738044 0.750000 Se\n0.294902 0.032946 0.250000 Se\n0.261956 0.294902 0.750000 Se\n0.738044 0.705098 0.250000 Se\n0.236213 0.411903 0.577220 O\n0.411903 0.175690 0.077220 O\n0.877368 0.490451 0.750000 O\n0.386919 0.877368 0.250000 O\n0.411903 0.175690 0.422780 O\n0.613081 0.122631 0.750000 O\n0.122631 0.509549 0.250000 O\n0.175690 0.763787 0.577220 O\n0.824309 0.236213 0.077220 O\n0.763787 0.588097 0.077220 O\n0.588097 0.824309 0.577220 O\n0.588097 0.824309 0.922780 O\n0.763787 0.588097 0.422780 O\n0.824309 0.236213 0.422780 O\n0.175690 0.763787 0.922780 O\n0.236213 0.411903 0.922780 O\n0.509549 0.386919 0.750000 O\n0.490451 0.613081 0.250000 O\n",
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"structure_string": "Li4 Mn4 Si4 O16\n1.0\n5.025379 0.000000 0.000000\n0.000000 6.863496 0.000000\n0.000000 0.000000 9.475464\nLi Mn Si O\n4 4 4 16\ndirect\n0.752960 0.471025 0.190719 Li\n0.252960 0.971026 0.309280 Li\n0.752960 0.028975 0.690719 Li\n0.252960 0.528975 0.809280 Li\n0.812820 0.976911 0.115801 Mn\n0.312819 0.476911 0.384199 Mn\n0.812820 0.523090 0.615801 Mn\n0.312819 0.023089 0.884199 Mn\n0.738760 0.731360 0.910246 Si\n0.238760 0.231359 0.589754 Si\n0.738760 0.768641 0.410246 Si\n0.238760 0.268641 0.089754 Si\n0.872659 0.567249 0.809830 O\n0.867687 0.958996 0.902035 O\n0.367686 0.458996 0.597964 O\n0.372659 0.067249 0.690169 O\n0.921163 0.258725 0.627575 O\n0.788106 0.798046 0.580857 O\n0.288106 0.201955 0.419143 O\n0.921163 0.241275 0.127575 O\n0.872659 0.932752 0.309830 O\n0.867687 0.541005 0.402035 O\n0.367686 0.041005 0.097965 O\n0.372659 0.432752 0.190169 O\n0.421163 0.758726 0.872425 O\n0.788106 0.701955 0.080857 O\n0.421163 0.741275 0.372425 O\n0.288106 0.298046 0.919143 O\n",
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{
"id": "jvasp-96599",
"created_at": "2022-09-04T14:36:06.333444Z",
"updated_at": "2022-09-04T14:36:06.333479Z",
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}