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{
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{
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"structure_string": "Li4 Al4 Si4 H8 O20\n1.0\n5.120294 0.000000 0.000000\n0.000000 7.999060 0.000000\n0.000000 0.000000 10.615657\nLi Al Si H O\n4 4 4 8 20\ndirect\n0.764751 0.157646 0.685521 Li\n0.264751 0.842354 0.314479 Li\n0.264751 0.657646 0.814479 Li\n0.764751 0.342354 0.185521 Li\n0.761287 0.566683 0.661043 Al\n0.261287 0.433317 0.338957 Al\n0.261287 0.066683 0.838957 Al\n0.761287 0.933317 0.161043 Al\n0.761675 0.853377 0.868210 Si\n0.261675 0.146623 0.131790 Si\n0.261675 0.353377 0.631790 Si\n0.761675 0.646623 0.368210 Si\n0.861812 0.610529 0.053257 H\n0.361812 0.389471 0.946743 H\n0.361812 0.110529 0.446743 H\n0.861812 0.889471 0.553257 H\n0.345428 0.539497 0.034100 H\n0.845428 0.460503 0.965900 H\n0.845428 0.039497 0.465900 H\n0.345428 0.960503 0.534100 H\n0.811089 0.677347 0.519205 O\n0.311089 0.322653 0.480795 O\n0.311089 0.177347 0.980795 O\n0.811089 0.822653 0.019205 O\n0.871157 0.690267 0.789496 O\n0.371157 0.309733 0.210504 O\n0.371157 0.190267 0.710504 O\n0.871157 0.809733 0.289496 O\n0.425642 0.519627 0.677417 O\n0.925642 0.480373 0.322583 O\n0.925642 0.019627 0.822583 O\n0.425642 0.980373 0.177417 O\n0.949902 0.379885 0.664915 O\n0.449902 0.620115 0.335085 O\n0.449902 0.879885 0.835085 O\n0.949902 0.120115 0.164915 O\n0.887157 0.487393 0.053242 O\n0.387157 0.512607 0.946758 O\n0.387157 0.987393 0.446758 O\n0.887157 0.012607 0.553242 O\n",
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"formula_full": "Li4 Al4 Si4 H8 O20",
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"spacegroup": 33
},
{
"id": "mp-684746",
"created_at": "2022-09-04T14:45:09.713110Z",
"structure_string": "Li2 Al2 Si4 H4 O14\n1.0\n6.509499 0.000000 0.000000\n1.891172 6.486192 0.000000\n1.669442 2.994197 6.445284\nLi Al Si H O\n2 2 4 4 14\ndirect\n0.929980 0.379731 0.573346 Li\n0.432209 0.489361 0.622756 Li\n0.006111 0.679196 0.738092 Al\n0.554865 0.963381 0.032074 Al\n0.456397 0.666603 0.880400 Si\n0.177321 0.126151 0.866813 Si\n0.730858 0.484470 0.231865 Si\n0.047517 0.082708 0.301567 Si\n0.609467 0.902817 0.260270 H\n0.684081 0.772295 0.573923 H\n0.999362 0.047140 0.849484 H\n0.300233 0.155436 0.417750 H\n0.263062 0.715891 0.748133 O\n0.146846 0.209714 0.400107 O\n0.837645 0.815771 0.913978 O\n0.979124 0.854496 0.475335 O\n0.119134 0.400648 0.733403 O\n0.416065 0.983062 0.805367 O\n0.536387 0.266755 0.882222 O\n0.849778 0.267517 0.173817 O\n0.693300 0.658599 0.718569 O\n0.476951 0.376497 0.026403 O\n0.515100 0.651279 0.110664 O\n0.685077 0.411511 0.471748 O\n0.920119 0.655875 0.116976 O\n0.219711 0.035396 0.113139 O\n",
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],
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"volume": 272.13188088550845,
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"formula_full": "Li2 Al2 Si4 H4 O14",
"formula_reduced": "LiAlSi2H2O7",
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"updated_at": "2021-11-28T01:36:57.723000Z",
"spacegroup": 1
},
{
"id": "mp-604430",
"created_at": "2022-09-04T14:41:29.803040Z",
"structure_string": "Li4 Al4 Si4 H8 O20\n1.0\n4.986549 0.000000 0.000000\n0.000000 8.427324 0.000000\n0.000000 0.000000 11.909818\nLi Al Si H O\n4 4 4 8 20\ndirect\n0.930314 0.969650 0.386376 Li\n0.930314 0.530350 0.886376 Li\n0.430314 0.030350 0.613624 Li\n0.430314 0.469650 0.113624 Li\n0.447230 0.690829 0.735741 Al\n0.947230 0.190829 0.764259 Al\n0.447230 0.809171 0.235741 Al\n0.947230 0.309171 0.264259 Al\n0.857632 0.664075 0.286277 Si\n0.357632 0.335925 0.713723 Si\n0.357632 0.164075 0.213723 Si\n0.857632 0.835925 0.786277 Si\n0.231895 0.796249 0.499394 H\n0.465063 0.155091 0.437237 H\n0.965063 0.844909 0.562763 H\n0.731895 0.296249 0.000606 H\n0.731895 0.203751 0.500606 H\n0.465063 0.344909 0.937237 H\n0.965063 0.655091 0.062763 H\n0.231895 0.703751 0.999394 H\n0.653552 0.718594 0.859618 O\n0.159330 0.343994 0.829625 O\n0.659330 0.656006 0.170375 O\n0.653552 0.781406 0.359618 O\n0.127331 0.612730 0.024518 O\n0.615278 0.277931 0.233210 O\n0.115278 0.777931 0.266790 O\n0.153552 0.218594 0.640382 O\n0.452274 0.507030 0.669167 O\n0.153552 0.281406 0.140382 O\n0.452274 0.992970 0.169167 O\n0.115278 0.722069 0.766790 O\n0.952274 0.007030 0.830833 O\n0.627331 0.112730 0.475482 O\n0.659330 0.843994 0.670375 O\n0.615278 0.222069 0.733210 O\n0.159330 0.156006 0.329625 O\n0.127331 0.887270 0.524518 O\n0.627331 0.387270 0.975482 O\n0.952274 0.492970 0.330833 O\n",
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"formula_full": "Li4 Al4 Si4 H8 O20",
"formula_reduced": "LiAlSiH2O5",
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"energy": -270.05458186,
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"updated_at": "2021-11-28T01:35:11.323000Z",
"spacegroup": 33
},
{
"id": "mp-1249890",
"created_at": "2022-09-04T14:41:36.882483Z",
"structure_string": "Li2 Al2 Si4 H4 O14\n1.0\n6.777139 1.380636 -0.027871\n1.346853 6.051518 3.162078\n0.059795 0.052432 7.657909\nLi Al Si H O\n2 2 4 4 14\ndirect\n0.163356 0.988316 0.615847 Li\n0.572398 0.898671 0.640055 Li\n0.958136 0.575953 0.753105 Al\n0.452057 0.015869 0.018065 Al\n0.524491 0.469776 0.877093 Si\n0.822950 0.989455 0.882868 Si\n0.290942 0.297693 0.226606 Si\n0.948429 0.598404 0.324538 Si\n0.406990 0.865293 0.230852 H\n0.293336 0.623267 0.585915 H\n0.998917 0.052191 0.902709 H\n0.752982 0.399649 0.324495 H\n0.717266 0.532986 0.777525 O\n0.878555 0.370814 0.406469 O\n0.166865 0.264660 0.904020 O\n0.967426 0.662571 0.496401 O\n0.862330 0.863794 0.744532 O\n0.584702 0.210924 0.821553 O\n0.422619 0.893079 0.855718 O\n0.171364 0.540076 0.241723 O\n0.290954 0.635364 0.708315 O\n0.464955 0.640524 0.997580 O\n0.490314 0.262942 0.103617 O\n0.342548 0.076758 0.440409 O\n0.090232 0.359878 0.046449 O\n0.778187 0.820593 0.111742 O\n",
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"formula_full": "Li2 Al2 Si4 H4 O14",
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},
{
"id": "mp-1204399",
"created_at": "2022-09-04T14:41:48.509632Z",
"structure_string": "Li4 Al4 Si4 H8 O20\n1.0\n5.070518 0.000000 0.000000\n0.000000 8.182561 0.000000\n0.000000 0.000000 10.113106\nLi Al Si H O\n4 4 4 8 20\ndirect\n0.753912 0.133530 0.650218 Li\n0.253912 0.866470 0.349782 Li\n0.253912 0.633530 0.849782 Li\n0.753912 0.366470 0.150218 Li\n0.750942 0.548909 0.674488 Al\n0.250942 0.451091 0.325512 Al\n0.250942 0.048909 0.825512 Al\n0.750942 0.951091 0.174488 Al\n0.752200 0.846804 0.866713 Si\n0.252200 0.153196 0.133287 Si\n0.252200 0.346804 0.633287 Si\n0.752200 0.653196 0.366713 Si\n0.054836 0.697441 0.055260 H\n0.554836 0.302559 0.944740 H\n0.554836 0.197441 0.444740 H\n0.054836 0.802559 0.555260 H\n0.344970 0.666183 0.102211 H\n0.844970 0.333817 0.897789 H\n0.844970 0.166183 0.397789 H\n0.344970 0.833817 0.602211 H\n0.797262 0.660331 0.526872 O\n0.297262 0.339669 0.473128 O\n0.297262 0.160331 0.973128 O\n0.797262 0.839669 0.026872 O\n0.869105 0.677958 0.801535 O\n0.369105 0.322042 0.198465 O\n0.369105 0.177958 0.698465 O\n0.869105 0.822042 0.301535 O\n0.411338 0.504747 0.695870 O\n0.911338 0.495253 0.304130 O\n0.911338 0.004747 0.804130 O\n0.411338 0.995253 0.195870 O\n0.937692 0.363902 0.672717 O\n0.437692 0.636098 0.327283 O\n0.437692 0.863902 0.827283 O\n0.937692 0.136098 0.172717 O\n0.208644 0.622571 0.043761 O\n0.708644 0.377429 0.956239 O\n0.708644 0.122571 0.456239 O\n0.208644 0.877429 0.543761 O\n",
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"formula_full": "Li4 Al4 Si4 H8 O20",
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{
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"structure_string": "Li4 Al4 Si4 H8 O20\n1.0\n4.796556 0.000000 0.000000\n0.000000 9.028016 0.000000\n0.000000 0.000000 11.744496\nLi Al Si H O\n4 4 4 8 20\ndirect\n0.379768 0.587490 0.809822 Li\n0.379768 0.912510 0.309822 Li\n0.879768 0.087490 0.690178 Li\n0.879768 0.412510 0.190178 Li\n0.355719 0.043949 0.859183 Al\n0.855719 0.956051 0.140817 Al\n0.355719 0.456051 0.359183 Al\n0.855719 0.543949 0.640817 Al\n0.768257 0.880973 0.885925 Si\n0.268257 0.380973 0.614075 Si\n0.268257 0.119027 0.114075 Si\n0.768257 0.619027 0.385925 Si\n0.885187 0.853777 0.551538 H\n0.209471 0.489246 0.990187 H\n0.709471 0.989246 0.509813 H\n0.385187 0.146223 0.448462 H\n0.709471 0.510754 0.009813 H\n0.385187 0.353777 0.948462 H\n0.885187 0.646223 0.051538 H\n0.209471 0.010754 0.490187 H\n0.972750 0.634080 0.768574 O\n0.523358 0.474386 0.673868 O\n0.883679 0.963977 0.552181 O\n0.472750 0.365920 0.231426 O\n0.712319 0.774363 0.307911 O\n0.472750 0.134080 0.731426 O\n0.212319 0.274363 0.192089 O\n0.350392 0.161223 0.981057 O\n0.383679 0.036023 0.447819 O\n0.350392 0.338777 0.481057 O\n0.850392 0.661223 0.518943 O\n0.850392 0.838777 0.018943 O\n0.883679 0.536023 0.052181 O\n0.972750 0.865920 0.268574 O\n0.712319 0.725637 0.807911 O\n0.212319 0.225637 0.692089 O\n0.023358 0.974386 0.826132 O\n0.023358 0.525614 0.326132 O\n0.523358 0.025614 0.173868 O\n0.383679 0.463977 0.947819 O\n",
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"formula_full": "Li4 Al4 Si4 H8 O20",
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{
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"structure_string": "Li4 Al4 Si6 H8 O24\n1.0\n0.000000 0.000000 -6.534309\n-9.014159 0.000000 -3.267154\n0.000000 9.424581 -3.267154\nLi Al Si H O\n4 4 6 8 24\ndirect\n0.541821 0.565515 0.078181 Li\n0.185516 0.434485 0.921819 Li\n0.370002 0.065515 0.421819 Li\n0.857336 0.934485 0.578181 Li\n0.327276 0.926195 0.185242 Al\n0.438713 0.073805 0.814758 Al\n0.262518 0.426195 0.314758 Al\n0.003471 0.573805 0.685242 Al\n0.312507 0.700289 0.427125 Si\n0.439921 0.299711 0.572875 Si\n0.489632 0.200289 0.072875 Si\n0.762796 0.799711 0.927125 Si\n0.998078 0.000000 0.000000 Si\n0.748078 0.500000 0.500000 Si\n0.820052 0.930706 0.311056 H\n0.061814 0.069294 0.688944 H\n0.881108 0.430706 0.188944 H\n0.500758 0.569294 0.811056 H\n0.695763 0.821852 0.406451 H\n0.924065 0.178148 0.593549 H\n0.852213 0.321852 0.093549 H\n0.267615 0.678148 0.906451 H\n0.543528 0.650189 0.478702 O\n0.672420 0.349811 0.521298 O\n0.772230 0.150189 0.021298 O\n0.943717 0.849811 0.978702 O\n0.545042 0.790603 0.063929 O\n0.399574 0.209397 0.936071 O\n0.358971 0.290603 0.436071 O\n0.085645 0.709397 0.563929 O\n0.349953 0.582459 0.307980 O\n0.240393 0.417541 0.692020 O\n0.407933 0.082459 0.192020 O\n0.682412 0.917541 0.807980 O\n0.964945 0.474175 0.356290 O\n0.795409 0.525825 0.643710 O\n0.071234 0.974175 0.143710 O\n0.189120 0.025825 0.856290 O\n0.711803 0.920237 0.404828 O\n0.036868 0.079763 0.595172 O\n0.866630 0.420237 0.095172 O\n0.382040 0.579763 0.904828 O\n0.284844 0.865580 0.361073 O\n0.511498 0.134420 0.638927 O\n0.395917 0.365580 0.138927 O\n0.900424 0.634420 0.861073 O\n",
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"formula_full": "Li4 Al4 Si6 H8 O24",
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},
{
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{
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{
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{
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{
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]
}