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{
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{
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"updated_at": "2022-09-04T14:36:12.104387Z",
"structure_string": "La4 Ga4 O12\n1.0\n5.551397 0.000000 0.000000\n-0.000000 5.554709 0.000000\n0.000000 0.000000 7.847768\nLa Ga O\n4 4 12\ndirect\n0.506437 0.529951 0.250000 La\n0.993564 0.029951 0.250000 La\n0.493563 0.470049 0.750000 La\n0.006437 0.970049 0.750000 La\n0.000000 0.500000 0.000000 Ga\n0.500000 0.000000 0.000000 Ga\n0.500000 0.000000 0.500000 Ga\n0.000000 0.500000 0.500000 Ga\n0.926667 0.512372 0.750000 O\n0.426667 0.987628 0.250000 O\n0.718180 0.282433 0.460686 O\n0.718180 0.282433 0.039315 O\n0.218179 0.217567 0.960686 O\n0.781821 0.782433 0.460686 O\n0.281821 0.717567 0.539315 O\n0.281821 0.717567 0.960686 O\n0.781821 0.782433 0.039315 O\n0.218179 0.217567 0.539315 O\n0.073334 0.487628 0.250000 O\n0.573334 0.012372 0.750000 O\n",
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{
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"created_at": "2022-09-04T14:36:14.903300Z",
"updated_at": "2022-09-04T14:36:14.903314Z",
"structure_string": "Cu8 H6 C4 N10\n1.0\n5.637945 0.000000 -0.000000\n-2.818972 4.882603 0.000000\n-0.000000 0.000000 10.938214\nCu H C N\n8 6 4 10\ndirect\n0.831788 0.663577 0.236312 Cu\n0.336422 0.168211 0.236312 Cu\n0.831788 0.168211 0.236312 Cu\n0.666666 0.333333 0.749527 Cu\n0.663577 0.831788 0.736312 Cu\n0.168211 0.336422 0.736312 Cu\n0.333333 0.666667 0.249527 Cu\n0.168211 0.831788 0.736312 Cu\n0.234949 0.469898 0.037079 H\n0.530101 0.765050 0.037079 H\n0.234949 0.765050 0.037079 H\n0.469898 0.234949 0.537079 H\n0.765050 0.234949 0.537079 H\n0.765050 0.530101 0.537079 H\n0.666666 0.333333 0.027307 C\n0.000000 0.000000 0.942103 C\n0.333333 0.666667 0.527307 C\n0.000000 0.000000 0.442103 C\n0.333333 0.666667 0.418897 N\n0.666666 0.333333 0.144854 N\n0.000000 0.000000 0.324502 N\n0.666666 0.333333 0.918896 N\n0.000000 0.000000 0.824502 N\n0.000000 0.000000 0.551319 N\n0.666666 0.333333 0.570518 N\n0.333333 0.666667 0.070518 N\n0.000000 0.000000 0.051319 N\n0.333333 0.666667 0.644854 N\n",
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{
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"created_at": "2022-09-04T14:35:41.682083Z",
"updated_at": "2022-09-04T14:35:41.682111Z",
"structure_string": "K8 Mn2 Mo8 O30\n1.0\n10.373256 -0.000000 -0.000000\n-5.186628 8.983503 -0.000000\n-0.000000 -0.000000 8.066690\nK Mn Mo O\n8 2 8 30\ndirect\n0.912384 0.611498 0.133952 K\n0.388501 0.300886 0.133952 K\n0.087616 0.388501 0.866048 K\n0.611499 0.699114 0.866048 K\n0.000000 0.000000 0.000000 K\n0.300885 0.912384 0.866048 K\n0.699115 0.087616 0.133952 K\n0.000000 0.000000 0.500000 K\n0.666667 0.333333 0.458005 Mn\n0.333333 0.666667 0.541995 Mn\n0.983977 0.659860 0.638907 Mo\n0.324116 0.983976 0.361094 Mo\n0.666667 0.333333 0.856789 Mo\n0.340140 0.324116 0.638907 Mo\n0.333333 0.666667 0.143211 Mo\n0.675884 0.016024 0.638907 Mo\n0.016023 0.340139 0.361094 Mo\n0.659861 0.675884 0.361094 Mo\n0.364087 0.507511 0.665058 O\n0.635913 0.492488 0.334942 O\n0.007904 0.269350 0.559593 O\n0.208942 0.991218 0.204430 O\n0.143424 0.635912 0.665058 O\n0.261445 0.992095 0.559593 O\n0.791058 0.008782 0.795570 O\n0.825503 0.346370 0.950044 O\n0.519501 0.331807 0.655477 O\n0.738555 0.007904 0.440407 O\n0.730650 0.738554 0.559593 O\n0.174497 0.653630 0.049956 O\n0.008781 0.217724 0.204430 O\n0.346370 0.520867 0.049956 O\n0.269350 0.261446 0.440407 O\n0.856576 0.364087 0.334942 O\n0.480499 0.668193 0.344523 O\n0.992096 0.730650 0.440407 O\n0.812307 0.480499 0.655477 O\n0.507512 0.143424 0.334942 O\n0.782276 0.791057 0.204430 O\n0.492488 0.856576 0.665058 O\n0.331807 0.812306 0.344523 O\n0.187693 0.519500 0.344523 O\n0.668193 0.187694 0.655477 O\n0.520867 0.174497 0.950044 O\n0.217724 0.208943 0.795570 O\n0.479133 0.825502 0.049956 O\n0.653630 0.479133 0.950044 O\n0.991219 0.782276 0.795570 O\n",
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{
"id": "jvasp-9750",
"created_at": "2022-09-04T14:38:13.245199Z",
"updated_at": "2022-09-04T14:38:13.245215Z",
"structure_string": "Ho2 Ta2 O8\n1.0\n0.000000 5.127251 -0.002235\n5.451736 0.000000 0.000000\n0.000000 -0.597133 -5.285626\nHo Ta O\n2 2 8\ndirect\n0.000000 0.765008 0.250000 Ho\n0.000000 0.234993 0.750001 Ho\n0.500000 0.697028 0.750001 Ta\n0.500000 0.302973 0.250001 Ta\n0.265993 0.561849 0.991186 O\n0.734008 0.561849 0.508816 O\n0.734008 0.438152 0.008816 O\n0.265993 0.438152 0.491186 O\n0.750151 0.079758 0.402789 O\n0.249849 0.079758 0.097213 O\n0.249849 0.920243 0.597213 O\n0.750152 0.920243 0.902789 O\n",
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{
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"created_at": "2022-09-04T14:35:45.107210Z",
"updated_at": "2022-09-04T14:35:45.107236Z",
"structure_string": "Co4 I4 N8 O8\n1.0\n3.823134 0.000000 0.000000\n-0.000000 10.365612 0.000000\n0.000000 0.000000 12.393230\nCo I N O\n4 4 8 8\ndirect\n0.749999 0.561122 0.285867 Co\n0.250000 0.438878 0.714133 Co\n0.749999 0.061122 0.214133 Co\n0.250000 0.938878 0.785867 Co\n0.250000 0.908979 0.150957 I\n0.749999 0.091021 0.849043 I\n0.250000 0.408979 0.349043 I\n0.749999 0.591021 0.650957 I\n0.749999 0.570833 0.153054 N\n0.749999 0.191403 0.137826 N\n0.250000 0.429167 0.846946 N\n0.749999 0.070833 0.346946 N\n0.749999 0.691403 0.362174 N\n0.250000 0.308597 0.637826 N\n0.250000 0.929167 0.653054 N\n0.250000 0.808597 0.862174 N\n0.250000 0.405721 0.939585 O\n0.749999 0.292612 0.095555 O\n0.250000 0.207388 0.595555 O\n0.749999 0.792612 0.404445 O\n0.250000 0.905721 0.560415 O\n0.250000 0.707388 0.904445 O\n0.749999 0.594278 0.060415 O\n0.749999 0.094278 0.439585 O\n",
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{
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"created_at": "2022-09-04T14:35:49.104180Z",
"updated_at": "2022-09-04T14:35:49.104214Z",
"structure_string": "H12 Cl4 O20\n1.0\n8.812547 0.000000 0.000000\n0.000000 5.389684 -0.000000\n0.000000 0.000000 7.170204\nH Cl O\n12 4 20\ndirect\n0.177970 0.900272 0.064487 H\n0.177970 0.599727 0.064487 H\n0.285360 0.749999 0.214581 H\n0.785360 0.749999 0.285418 H\n0.677970 0.599727 0.435513 H\n0.677970 0.900272 0.435513 H\n0.714640 0.250000 0.785418 H\n0.822030 0.099728 0.935512 H\n0.822030 0.400272 0.935512 H\n0.214640 0.250000 0.714581 H\n0.322030 0.400272 0.564487 H\n0.322030 0.099728 0.564487 H\n0.585082 0.749999 0.802900 Cl\n0.085081 0.749999 0.697100 Cl\n0.914919 0.250000 0.302900 Cl\n0.414919 0.250000 0.197100 Cl\n0.093219 0.528296 0.818316 O\n0.686842 0.749999 0.354522 O\n0.186841 0.749999 0.145478 O\n0.406782 0.028297 0.318316 O\n0.906782 0.471703 0.181684 O\n0.593219 0.528296 0.681684 O\n0.093219 0.971703 0.818316 O\n0.593219 0.971703 0.681684 O\n0.406782 0.471703 0.318316 O\n0.283027 0.250000 0.071349 O\n0.445092 0.749999 0.906771 O\n0.945092 0.749999 0.593229 O\n0.554909 0.250000 0.093229 O\n0.054909 0.250000 0.406771 O\n0.716973 0.749999 0.928651 O\n0.216973 0.749999 0.571348 O\n0.813159 0.250000 0.854522 O\n0.783027 0.250000 0.428651 O\n0.906782 0.028297 0.181684 O\n0.313159 0.250000 0.645478 O\n",
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"structure_string": "H36 Br4 O16\n1.0\n5.981810 -0.000524 -2.779653\n0.000136 12.139243 0.000093\n-0.202031 -0.000215 7.699591\nH Br O\n36 4 16\ndirect\n0.416403 0.341622 -0.003036 H\n0.557429 0.449383 0.549966 H\n0.301486 0.328990 0.565681 H\n0.442602 0.949235 0.450067 H\n0.698488 0.829114 0.434254 H\n0.454239 0.570467 0.893875 H\n0.402900 0.534797 0.665966 H\n0.341599 0.666285 0.710730 H\n0.658248 0.166310 0.289632 H\n0.596774 0.034743 0.333881 H\n0.036454 0.458446 0.046138 H\n0.290477 0.455232 0.385005 H\n0.912170 0.459499 0.180399 H\n0.087595 -0.040633 0.819587 H\n-0.036802 -0.041652 0.953816 H\n0.709563 0.955229 0.615041 H\n-0.061385 0.764438 0.478001 H\n0.710971 0.762222 0.244262 H\n0.545762 0.070571 0.106252 H\n0.289105 0.262141 0.755747 H\n0.253021 0.243391 -0.008890 H\n0.583415 0.841701 0.002960 H\n0.747079 0.743453 0.008896 H\n0.039412 0.289817 0.121461 H\n0.067740 0.156253 0.144411 H\n-0.039563 0.789800 0.878393 H\n-0.067692 0.656260 0.855491 H\n0.586568 0.154076 0.694732 H\n0.821653 0.209743 0.833798 H\n0.413557 0.654064 0.305246 H\n0.178404 0.709757 0.166173 H\n0.726009 0.335021 0.359726 H\n0.747835 0.248400 0.529972 H\n0.273915 0.835086 0.640152 H\n0.252259 0.748355 0.470173 H\n0.061586 0.264391 0.521913 H\n0.573191 0.494562 0.176727 Br\n0.426439 0.994597 0.823110 Br\n0.060850 0.989382 0.271622 Br\n0.939054 0.489405 0.728088 Br\n0.051737 0.433058 0.174942 O\n0.555075 0.097731 0.232890 O\n0.444755 0.597708 0.767191 O\n0.604059 0.945004 0.473474 O\n0.395946 0.445101 0.526577 O\n0.767273 0.761033 0.405271 O\n0.232784 0.260990 0.594857 O\n0.214032 0.761736 0.584072 O\n0.302135 0.708571 0.301275 O\n0.697874 0.208663 0.698734 O\n-0.050085 0.720240 0.942284 O\n0.050046 0.220260 0.057612 O\n0.629477 0.765612 0.052651 O\n0.370295 0.265585 0.947056 O\n0.785907 0.261690 0.415945 O\n-0.052104 -0.067003 0.824956 O\n",
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}