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{
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"structure_string": "Ca4 Sm1 B3 O10\n1.0\n3.562970 -0.004888 0.315843\n1.266981 7.141531 3.664223\n-0.007481 0.002837 9.007595\nCa Sm B O\n4 1 3 10\ndirect\n0.669627 0.528705 0.225815 Ca\n0.340502 0.083530 0.365157 Ca\n0.340502 0.448688 0.634843 Ca\n0.669627 0.754521 0.774185 Ca\n0.000292 0.000078 -0.000000 Sm\n0.914329 0.757916 0.388890 B\n0.296686 0.376923 -0.000000 B\n0.914329 0.146807 0.611110 B\n0.916738 0.947678 0.286988 O\n0.916739 0.234666 0.713012 O\n0.246772 0.537533 0.850386 O\n0.718379 0.700711 0.537798 O\n0.112413 0.966989 0.657449 O\n0.112413 0.624438 0.342551 O\n0.246772 0.387918 0.149614 O\n0.397031 0.203170 -0.000000 O\n0.580395 0.823316 -0.000000 O\n0.718379 0.238511 0.462201 O\n",
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"structure_string": "Li2 V2 Co2 O8\n1.0\n5.136407 -0.003526 -0.000000\n2.020344 4.722383 0.000000\n0.000000 0.000000 6.114468\nLi V Co O\n2 2 2 8\ndirect\n0.337496 0.337495 0.750000 Li\n0.662504 0.662503 0.250000 Li\n0.352496 0.352495 0.250000 V\n0.647504 0.647503 0.750000 V\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n0.234467 0.234466 0.023940 O\n0.234467 0.234466 0.476060 O\n0.236578 0.728092 0.250000 O\n0.271907 0.763421 0.750000 O\n0.728093 0.236578 0.250000 O\n0.763422 0.271907 0.750000 O\n0.765534 0.765532 0.523940 O\n0.765534 0.765532 0.976060 O\n",
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{
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"updated_at": "2022-09-04T14:37:28.609441Z",
"structure_string": "Rb2 Al2 H16 N8\n1.0\n7.302539 0.000000 -0.000000\n-0.000000 7.302539 -0.000000\n-0.000000 -0.000000 5.016771\nRb Al H N\n2 2 16 8\ndirect\n0.500000 -0.000000 0.688911 Rb\n0.000000 0.500000 0.311089 Rb\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.000000 Al\n0.791235 0.336163 0.810999 H\n0.631755 0.634970 0.424002 H\n0.836163 0.708765 0.810999 H\n0.365030 0.631755 0.575998 H\n0.634970 0.368245 0.575998 H\n0.163837 0.291235 0.810999 H\n0.208765 0.663837 0.810999 H\n0.368245 0.365030 0.424002 H\n0.131755 0.134970 0.575998 H\n0.336163 0.208765 0.189001 H\n0.865030 0.131755 0.424002 H\n0.134970 0.868245 0.424002 H\n0.663837 0.791235 0.189001 H\n0.868245 0.865030 0.575998 H\n0.708765 0.163837 0.189001 H\n0.291235 0.836163 0.189001 H\n0.675726 0.408858 0.762457 N\n0.091142 0.175726 0.762457 N\n0.824274 0.091142 0.237543 N\n0.175726 -0.091142 0.237543 N\n-0.091142 0.824274 0.762457 N\n0.591143 0.675726 0.237543 N\n0.324274 0.591143 0.762457 N\n0.408858 0.324274 0.237543 N\n",
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{
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"created_at": "2022-09-04T14:37:06.900815Z",
"updated_at": "2022-09-04T14:37:06.900837Z",
"structure_string": "Li1 Co1 Cu1 O4\n1.0\n0.000000 5.011348 2.196160\n2.775466 0.000000 0.000000\n0.000000 -3.913782 -7.088977\nLi Co Cu O\n1 1 1 4\ndirect\n0.500000 0.500001 0.000000 Li\n0.000001 0.500001 0.500000 Co\n0.500001 0.000000 0.500000 Cu\n0.643772 0.000000 0.261677 O\n0.138721 0.500001 0.348008 O\n0.356230 0.000000 0.738324 O\n0.861280 0.500001 0.651993 O\n",
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{
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"created_at": "2022-09-04T14:37:06.901927Z",
"updated_at": "2022-09-04T14:37:06.901947Z",
"structure_string": "K2 Hg1 As1 I6\n1.0\n7.263559 -0.000000 4.193618\n2.421186 6.848149 4.193618\n-0.000000 -0.000000 8.387235\nK Hg As I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 As\n0.757184 0.242817 0.242817 I\n0.242817 0.242817 0.757184 I\n0.242817 0.757184 0.757184 I\n0.242817 0.757184 0.242817 I\n0.757184 0.242817 0.757184 I\n0.757184 0.757184 0.242817 I\n",
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{
"id": "jvasp-101942",
"created_at": "2022-09-04T14:37:06.595619Z",
"updated_at": "2022-09-04T14:37:06.595646Z",
"structure_string": "Hf1 H8 C6 O4\n1.0\n3.801668 -0.119869 0.323700\n-1.201147 4.296323 -1.380396\n-0.081050 0.067975 9.676806\nHf H C O\n1 8 6 4\ndirect\n0.021146 0.872656 0.691388 Hf\n0.769566 0.893519 0.085106 H\n0.294797 0.803221 0.117010 H\n0.789827 0.418569 0.148256 H\n0.305764 0.273229 0.144818 H\n0.048486 0.007797 0.328951 H\n0.660917 0.142794 0.352550 H\n0.241180 0.652153 0.364781 H\n0.586658 0.509461 0.398264 H\n0.517357 0.695375 0.078452 C\n0.537993 0.490824 0.173967 C\n0.525051 0.651125 0.335809 C\n0.870364 0.113996 0.546262 C\n0.782247 0.985978 0.384896 C\n0.428835 0.530402 0.920779 C\n0.196915 0.254829 0.886097 O\n0.963602 0.438679 0.585985 O\n0.573020 -0.009676 0.636911 O\n0.568307 0.681232 0.829254 O\n",
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{
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"created_at": "2022-09-04T14:37:28.392958Z",
"updated_at": "2022-09-04T14:37:28.392976Z",
"structure_string": "Mg4 Cr2 Sb2 O12\n1.0\n0.000000 5.132471 0.002029\n7.601631 0.000000 0.000000\n0.000000 -0.049838 -5.330544\nMg Cr Sb O\n4 2 2 12\ndirect\n0.481110 0.750000 0.427265 Mg\n0.518890 0.250000 0.572734 Mg\n0.998742 0.750000 0.959806 Mg\n0.001258 0.250000 0.040193 Mg\n0.500000 0.500000 -0.000000 Cr\n0.500000 0.000000 -0.000000 Cr\n-0.000000 0.500000 0.500000 Sb\n-0.000000 0.000000 0.500000 Sb\n0.320544 0.570685 0.682522 O\n0.626076 0.750000 0.069644 O\n0.679456 0.070685 0.317477 O\n0.139430 0.250000 0.427656 O\n0.178994 0.929230 0.187114 O\n0.821005 0.070770 0.812885 O\n0.178994 0.570770 0.187114 O\n0.320544 0.929315 0.682522 O\n0.860569 0.750000 0.572343 O\n0.679456 0.429315 0.317477 O\n0.821005 0.429230 0.812885 O\n0.373924 0.250000 0.930355 O\n",
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"formula_full": "Mg4 Cr2 Sb2 O12",
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{
"id": "jvasp-42296",
"created_at": "2022-09-04T14:37:28.380330Z",
"updated_at": "2022-09-04T14:37:28.380350Z",
"structure_string": "K2 Li4 Mn4 O8\n1.0\n0.000000 3.247522 0.020238\n12.493117 0.000000 0.000000\n0.000000 -0.323598 -5.398177\nK Li Mn O\n2 4 4 8\ndirect\n0.944574 0.250000 0.349146 K\n0.055425 0.750000 0.650854 K\n0.532286 0.643617 0.142460 Li\n0.532286 0.856384 0.142460 Li\n0.467713 0.356384 0.857540 Li\n0.467713 0.143617 0.857540 Li\n0.499999 0.500000 0.500000 Mn\n0.499999 0.000000 0.500000 Mn\n0.000000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.957837 0.099837 0.718611 O\n0.042162 0.599837 0.281389 O\n0.042162 0.900163 0.281389 O\n0.577971 0.588917 0.828997 O\n0.577971 0.911083 0.828997 O\n0.422028 0.411083 0.171003 O\n0.422028 0.088917 0.171003 O\n0.957837 0.400163 0.718611 O\n",
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{
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"structure_string": "Zn4 Cu2 W2 O12\n1.0\n0.000000 5.001263 0.007954\n5.107185 0.000000 0.000000\n0.000000 -4.888541 -8.571515\nZn Cu W O\n4 2 2 12\ndirect\n0.255090 0.973341 0.263319 Zn\n0.744911 0.473341 0.236682 Zn\n0.744911 0.026660 0.736682 Zn\n0.255090 0.526660 0.763319 Zn\n0.500000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.500000 W\n0.000000 0.500000 0.000000 W\n0.661669 0.116522 0.300939 O\n0.338331 0.616523 0.199062 O\n0.725817 0.691907 0.045447 O\n0.274184 0.191907 0.454554 O\n0.274184 0.308094 0.954554 O\n0.918522 0.198962 0.103207 O\n0.081479 0.801039 0.896794 O\n0.918522 0.301039 0.603207 O\n0.338332 0.883479 0.699062 O\n0.081478 0.698962 0.396794 O\n0.725817 0.808094 0.545447 O\n0.661669 0.383478 0.800939 O\n",
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{
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"created_at": "2022-09-04T14:37:07.514714Z",
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"structure_string": "Ti1 Zn1 Bi2 O6\n1.0\n4.923976 0.000018 0.000000\n0.000019 5.287058 0.000000\n0.000000 0.000000 5.287051\nTi Zn Bi O\n1 1 2 6\ndirect\n0.585007 0.500001 0.500000 Ti\n0.555331 -0.000001 0.000000 Zn\n0.006674 -0.000002 0.500000 Bi\n0.006675 0.499991 0.000000 Bi\n0.726046 0.742922 0.742921 O\n0.726046 0.742922 0.257079 O\n0.168833 0.000009 0.000000 O\n0.220298 0.500002 0.500000 O\n0.726047 0.257079 0.257079 O\n0.726047 0.257079 0.742920 O\n",
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{
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"created_at": "2022-09-04T14:36:59.421142Z",
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{
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"created_at": "2022-09-04T14:36:40.514204Z",
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"structure_string": "Sc1 Nb1 Pb2 O6\n1.0\n5.022641 0.000000 2.899823\n1.674214 4.735390 2.899823\n-0.000000 -0.000000 5.799645\nSc Nb Pb O\n1 1 2 6\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Nb\n0.250000 0.250000 0.250000 Pb\n0.749999 0.750000 0.750000 Pb\n0.254711 0.254711 0.745290 O\n0.745288 0.745289 0.254711 O\n0.254710 0.745289 0.254711 O\n0.745289 0.254711 0.745289 O\n0.745289 0.254711 0.254711 O\n0.254710 0.745289 0.745290 O\n",
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]
}