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{
"id": "jvasp-20339",
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"structure_string": "Ho16 O24\n1.0\n8.640066 0.000000 -3.054725\n-4.320033 7.482517 -3.054725\n-0.000000 -0.000000 9.164174\nHo O\n16 24\ndirect\n0.499991 0.499991 0.499991 Ho\n0.750001 0.782461 0.032462 Ho\n0.467539 0.250000 0.717539 Ho\n0.717539 0.467539 0.250001 Ho\n0.032462 0.750000 0.782461 Ho\n0.782461 0.032461 0.750000 Ho\n0.750000 0.282468 0.532468 Ho\n0.250001 0.717539 0.467539 Ho\n0.217533 0.967533 0.250001 Ho\n0.532468 0.750000 0.282468 Ho\n0.282468 0.532468 0.750000 Ho\n0.250000 0.217533 0.967532 Ho\n0.000010 0.500000 0.000000 Ho\n0.500000 0.000000 0.000010 Ho\n0.967533 0.250000 0.217533 Ho\n0.000000 0.000010 0.500000 Ho\n0.270917 0.739590 0.227746 O\n0.229084 0.456828 0.468673 O\n0.011845 0.043172 0.272255 O\n0.031327 0.488155 0.760410 O\n0.729095 0.260417 0.772267 O\n0.227745 0.270917 0.739590 O\n0.988152 0.956828 0.727735 O\n0.511850 0.239583 0.968677 O\n0.543173 0.531323 0.770906 O\n0.531323 0.770906 0.543173 O\n0.772267 0.729095 0.260418 O\n0.956829 0.727734 0.988152 O\n0.968678 0.511849 0.239584 O\n0.488156 0.760410 0.031328 O\n0.260418 0.772267 0.729095 O\n0.239584 0.968678 0.511850 O\n0.770906 0.543172 0.531324 O\n0.043172 0.272255 0.011845 O\n0.760410 0.031327 0.488155 O\n0.739590 0.227745 0.270917 O\n0.468673 0.229083 0.456828 O\n0.456829 0.468673 0.229084 O\n0.727735 0.988151 0.956829 O\n0.272255 0.011845 0.043172 O\n",
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{
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"updated_at": "2022-09-04T14:37:06.779321Z",
"structure_string": "H16 C20 S4\n1.0\n4.672285 -0.047352 -0.150483\n-1.002892 8.226195 -2.598129\n-0.032376 -0.007258 10.753478\nH C S\n16 20 4\ndirect\n0.620771 0.882831 0.854226 H\n0.160768 0.511884 0.056157 H\n0.660770 0.511882 0.556159 H\n0.910769 0.011883 0.306158 H\n0.966516 0.085577 0.597117 H\n0.466511 0.085581 0.097116 H\n0.716513 0.585579 0.847116 H\n0.216513 0.585579 0.347116 H\n0.410768 0.011882 0.806159 H\n0.845802 0.338458 0.223554 H\n0.095803 0.838456 0.973553 H\n0.595803 0.838456 0.473554 H\n0.370769 0.382832 0.104226 H\n0.870773 0.382830 0.604226 H\n0.120769 0.882832 0.354226 H\n0.345804 0.338454 0.723553 H\n0.465534 0.802193 0.656045 C\n0.965534 0.802194 0.156044 C\n0.715534 0.302193 0.406045 C\n0.215532 0.302193 0.906044 C\n0.838857 0.438267 0.525252 C\n0.088855 0.938268 0.275252 C\n0.338855 0.438268 0.025252 C\n0.851523 0.059513 0.784705 C\n0.588856 0.938267 0.775252 C\n0.351521 0.059514 0.284704 C\n0.002333 0.129127 0.703421 C\n0.101522 0.559513 0.534705 C\n0.209741 0.267405 0.772560 C\n0.709740 0.267407 0.272560 C\n0.959742 0.767407 0.022560 C\n0.459740 0.767406 0.522560 C\n0.502332 0.129129 0.203421 C\n0.752332 0.629128 0.953421 C\n0.252333 0.629128 0.453421 C\n0.601522 0.559514 0.034705 C\n0.471685 0.161725 0.445515 S\n0.221685 0.661725 0.695516 S\n0.721685 0.661727 0.195516 S\n0.971684 0.161727 0.945516 S\n",
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{
"id": "jvasp-5677",
"created_at": "2022-09-04T14:36:45.389458Z",
"updated_at": "2022-09-04T14:36:45.389467Z",
"structure_string": "Al16 Te24\n1.0\n0.000000 7.266691 -0.020945\n12.947807 0.000000 0.000000\n0.000000 0.024808 -14.375663\nAl Te\n16 24\ndirect\n0.418392 0.249668 0.686538 Al\n0.569076 0.431784 0.317572 Al\n0.430925 0.931784 0.182428 Al\n0.569076 0.068216 0.817572 Al\n0.920232 0.092273 0.193848 Al\n0.079768 0.592273 0.306152 Al\n0.079768 0.907727 0.806152 Al\n0.920232 0.407727 0.693848 Al\n0.430925 0.568216 0.682428 Al\n0.069199 0.908778 0.325975 Al\n0.069199 0.591222 0.825975 Al\n0.930801 0.091222 0.674025 Al\n0.418392 0.250332 0.186538 Al\n0.581608 0.750332 0.313462 Al\n0.581608 0.749668 0.813462 Al\n0.930801 0.408778 0.174025 Al\n0.088409 0.918807 0.626917 Te\n0.088409 0.581193 0.126917 Te\n0.911591 0.081193 0.373084 Te\n0.595156 0.405805 0.602545 Te\n0.573567 0.072067 0.629071 Te\n0.404844 0.594195 0.397455 Te\n0.595156 0.094195 0.102545 Te\n0.426434 0.572067 0.870929 Te\n0.911591 0.418807 0.873083 Te\n0.404844 0.905805 0.897455 Te\n0.926270 0.413822 0.362261 Te\n0.090654 0.242957 0.098725 Te\n0.073730 0.586178 0.637740 Te\n0.926270 0.086178 0.862260 Te\n0.416634 0.258372 0.365548 Te\n0.583366 0.758372 0.134452 Te\n0.583367 0.741629 0.634452 Te\n0.416634 0.241628 0.865548 Te\n0.426433 0.927933 0.370929 Te\n0.909346 0.742957 0.401275 Te\n0.909346 0.757043 0.901275 Te\n0.090655 0.257043 0.598725 Te\n0.073730 0.913822 0.137740 Te\n0.573567 0.427933 0.129071 Te\n",
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{
"id": "jvasp-20193",
"created_at": "2022-09-04T14:37:32.798188Z",
"updated_at": "2022-09-04T14:37:32.798220Z",
"structure_string": "Tm16 O24\n1.0\n8.523550 -0.000000 -3.013531\n-4.261775 7.381610 -3.013531\n0.000000 0.000000 9.040591\nTm O\n16 24\ndirect\n0.250000 0.717068 0.467067 Tm\n0.500000 0.500000 0.500000 Tm\n-0.000000 -0.000000 0.500000 Tm\n0.500000 0.000000 0.000000 Tm\n-0.000000 0.500000 -0.000000 Tm\n0.250000 0.217068 0.967067 Tm\n0.532932 0.750000 0.282932 Tm\n0.282932 0.532932 0.750000 Tm\n0.967067 0.250000 0.217068 Tm\n0.750000 0.282932 0.532932 Tm\n0.750000 0.782932 0.032932 Tm\n0.717067 0.467068 0.250000 Tm\n0.467067 0.250000 0.717068 Tm\n0.782932 0.032932 0.750000 Tm\n0.217067 0.967068 0.250000 Tm\n0.032932 0.750000 0.782932 Tm\n0.228764 0.456352 0.467991 O\n0.032009 0.488361 0.760773 O\n0.227588 0.271236 0.739227 O\n0.272412 0.011639 0.043648 O\n0.532009 0.771236 0.543648 O\n0.271235 0.739227 0.227588 O\n0.988361 0.956352 0.727588 O\n0.260773 0.772412 0.728764 O\n0.511639 0.239227 0.967991 O\n0.956352 0.727588 0.988361 O\n0.728764 0.260773 0.772412 O\n0.239226 0.967991 0.511639 O\n0.543647 0.532009 0.771236 O\n0.760773 0.032009 0.488361 O\n0.771235 0.543648 0.532009 O\n0.772412 0.728764 0.260773 O\n0.967991 0.511639 0.239227 O\n0.467991 0.228764 0.456352 O\n0.011639 0.043648 0.272412 O\n0.739227 0.227588 0.271236 O\n0.488361 0.760773 0.032009 O\n0.043648 0.272412 0.011639 O\n0.727587 0.988361 0.956352 O\n0.456352 0.467991 0.228764 O\n",
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{
"id": "jvasp-22973",
"created_at": "2022-09-04T14:37:32.801063Z",
"updated_at": "2022-09-04T14:37:32.801095Z",
"structure_string": "K8 Li12 Ga4 O16\n1.0\n0.000000 5.540330 0.009321\n8.778813 0.000000 0.000000\n0.000000 -3.978904 -10.209076\nK Li Ga O\n8 12 4 16\ndirect\n0.296982 0.992635 0.138964 K\n0.703019 0.492635 0.361036 K\n0.703020 0.007365 0.861036 K\n0.296982 0.507365 0.638964 K\n0.280301 0.724835 0.392048 K\n0.719699 0.224835 0.107953 K\n0.719700 0.275165 0.607953 K\n0.280302 0.775164 0.892048 K\n0.374048 0.508881 0.070780 Li\n0.374048 0.991118 0.570780 Li\n0.625954 0.491118 0.929220 Li\n0.092939 0.463555 0.203529 Li\n0.907062 0.963555 0.296471 Li\n0.625953 0.008881 0.429220 Li\n0.092939 0.036445 0.703530 Li\n0.381774 0.238463 0.299067 Li\n0.618227 0.738463 0.200933 Li\n0.618227 0.761537 0.700933 Li\n0.381774 0.261537 0.799067 Li\n0.907063 0.536445 0.796471 Li\n0.101255 0.211798 0.436948 Ga\n0.898745 0.711797 0.063053 Ga\n0.101256 0.288202 0.936948 Ga\n0.898746 0.788202 0.563053 Ga\n0.220016 0.106606 0.885555 O\n0.257378 0.049198 0.376478 O\n0.220016 0.393393 0.385555 O\n0.742623 0.549197 0.123523 O\n0.779985 0.893393 0.114445 O\n0.779985 0.606606 0.614445 O\n0.233659 0.310674 0.120578 O\n0.256065 0.677438 0.143087 O\n0.766343 0.689325 0.879423 O\n0.233659 0.189325 0.620578 O\n0.743935 0.177438 0.356913 O\n0.256066 0.822562 0.643087 O\n0.743936 0.322562 0.856914 O\n0.742624 0.950802 0.623523 O\n0.766342 0.810674 0.379422 O\n0.257378 0.450802 0.876478 O\n",
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{
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"created_at": "2022-09-04T14:36:19.845849Z",
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"structure_string": "Li12 H24 Ir4\n1.0\n8.490002 -0.000000 0.000000\n-0.000000 4.751497 0.000000\n0.000000 0.000000 8.469586\nLi H Ir\n12 24 4\ndirect\n0.541478 0.250000 0.869924 Li\n0.771424 0.750000 0.758371 Li\n0.271424 0.750000 0.741630 Li\n0.228576 0.250000 0.241629 Li\n0.602642 0.750000 0.478232 Li\n0.102642 0.750000 0.021768 Li\n0.728576 0.250000 0.258371 Li\n0.897358 0.250000 0.978233 Li\n0.958521 0.750000 0.369923 Li\n0.458522 0.750000 0.130077 Li\n0.041478 0.250000 0.630077 Li\n0.397358 0.250000 0.521768 Li\n0.387414 0.750000 0.559347 H\n0.105140 0.495566 0.820801 H\n0.612586 0.250000 0.440654 H\n0.112586 0.250000 0.059347 H\n0.887414 0.750000 0.940654 H\n0.225879 0.250000 0.896994 H\n0.334526 0.250000 0.733940 H\n0.165473 0.750000 0.233940 H\n0.665473 0.750000 0.266060 H\n0.725879 0.250000 0.603007 H\n0.605140 0.004434 0.679200 H\n0.834526 0.250000 0.766061 H\n0.894859 0.995566 0.179199 H\n0.346030 0.498634 0.971173 H\n0.894859 0.504434 0.179199 H\n0.394860 0.995566 0.320801 H\n0.105140 0.004434 0.820801 H\n0.605140 0.495566 0.679200 H\n0.274121 0.750000 0.396994 H\n0.846030 0.001366 0.528828 H\n0.653969 -0.001366 0.028827 H\n0.153970 0.501367 0.471173 H\n0.653969 0.501367 0.028827 H\n0.153970 -0.001366 0.471173 H\n0.346030 0.001366 0.971173 Ir\n0.846030 0.498634 0.528828 Ir\n0.394860 0.504434 0.320801 Ir\n0.774121 0.750000 0.103007 Ir\n",
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{
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"created_at": "2022-09-04T14:35:42.265371Z",
"updated_at": "2022-09-04T14:35:42.265398Z",
"structure_string": "Li8 Cu16 O16\n1.0\n5.738455 0.000000 0.000000\n-0.000000 5.738455 0.000000\n-0.000000 -0.000000 12.533072\nLi Cu O\n8 16 16\ndirect\n0.506054 0.750001 0.679125 Li\n0.493947 0.250000 0.320874 Li\n0.750001 0.993948 0.179125 Li\n0.750001 0.506054 0.179125 Li\n0.006053 0.250000 0.320874 Li\n0.250000 0.493947 0.820874 Li\n0.250000 0.006053 0.820874 Li\n0.993948 0.750001 0.679125 Li\n0.750001 0.002294 0.847389 Cu\n0.750001 0.497706 0.847389 Cu\n0.750001 0.001708 0.492566 Cu\n0.998293 0.250000 0.007434 Cu\n0.497706 0.750001 0.347389 Cu\n0.001708 0.750001 0.992565 Cu\n0.501708 0.250000 0.007434 Cu\n0.250000 0.502295 0.152611 Cu\n0.250000 0.998293 0.507434 Cu\n0.250000 0.997707 0.152611 Cu\n0.750001 0.498293 0.492566 Cu\n0.002294 0.750001 0.347389 Cu\n0.250000 0.501708 0.507434 Cu\n0.502295 0.250000 0.652611 Cu\n0.498293 0.750001 0.992565 Cu\n0.997707 0.250000 0.652611 Cu\n0.250000 0.007979 0.657539 O\n0.250000 0.492022 0.657539 O\n0.492022 0.250000 0.157539 O\n0.992381 0.250000 0.858846 O\n0.507979 0.750001 0.842461 O\n0.750001 0.992022 0.342461 O\n0.492380 0.750001 0.141154 O\n0.507621 0.250000 0.858846 O\n0.250000 0.507621 0.358846 O\n0.750001 0.507979 0.342461 O\n0.007979 0.250000 0.157539 O\n0.250000 0.992381 0.358846 O\n0.750001 0.007620 0.641154 O\n0.992022 0.750001 0.842461 O\n0.007620 0.750001 0.141154 O\n0.750001 0.492380 0.641154 O\n",
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{
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"structure_string": "Ba8 H16 O16\n1.0\n9.361918 0.000000 -0.894328\n0.000000 7.897706 0.000000\n0.044436 0.000000 6.792637\nBa H O\n8 16 16\ndirect\n0.895108 0.144782 0.251655 Ba\n0.395108 0.355219 0.751656 Ba\n0.104893 0.855219 0.748345 Ba\n0.604893 0.644782 0.248345 Ba\n0.317909 0.050266 0.281624 Ba\n0.817909 0.449734 0.781624 Ba\n0.682092 0.949734 0.718376 Ba\n0.182091 0.550266 0.218376 Ba\n0.092638 0.238554 0.555461 H\n0.592638 0.261446 0.055461 H\n0.907363 0.761446 0.444539 H\n0.407363 0.738555 0.944539 H\n0.120398 0.274177 0.936530 H\n0.379602 0.774177 0.563470 H\n0.879602 0.725823 0.063470 H\n0.620398 0.225823 0.436530 H\n0.977020 0.148819 0.780830 H\n0.522981 0.648818 0.719170 H\n0.022981 0.851183 0.219170 H\n0.882508 0.539997 0.313270 H\n0.382508 0.960004 0.813270 H\n0.117492 0.460003 0.686731 H\n0.617492 0.039997 0.186730 H\n0.477019 0.351181 0.280830 H\n0.841087 0.702179 0.525724 O\n0.341087 0.797822 0.025724 O\n0.605519 0.339883 0.490602 O\n0.105519 0.160118 0.990603 O\n0.394482 0.660118 0.509398 O\n0.894481 0.839883 0.009397 O\n0.417293 0.361553 0.152341 O\n0.880651 0.494084 0.177819 O\n0.582708 0.638448 0.847659 O\n0.082708 0.861553 0.347659 O\n0.380651 0.005917 0.677821 O\n0.119349 0.505917 0.822180 O\n0.619349 0.994084 0.322180 O\n0.658914 0.202178 0.974276 O\n0.917293 0.138448 0.652341 O\n0.158914 0.297822 0.474276 O\n",
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{
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