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{
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{
"id": "mp-643829",
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"structure_string": "Al4 Si4 H4 O16\n1.0\n4.407307 0.000000 0.000000\n0.000000 7.073605 0.000000\n0.000000 5.961592 7.123331\nAl Si H O\n4 4 4 16\ndirect\n0.473062 0.640893 0.564306 Al\n0.026938 0.640893 0.064306 Al\n0.526938 0.359107 0.435694 Al\n0.973062 0.359107 0.935694 Al\n0.477003 0.906389 0.180476 Si\n0.022997 0.906389 0.680476 Si\n0.522997 0.093611 0.819524 Si\n0.977003 0.093611 0.319524 Si\n0.966316 0.638248 0.312752 H\n0.533684 0.638248 0.812752 H\n0.033684 0.361752 0.687248 H\n0.466316 0.361752 0.187248 H\n0.295564 0.107487 0.653137 O\n0.204436 0.107487 0.153137 O\n0.704436 0.892513 0.346863 O\n0.795564 0.892513 0.846863 O\n0.309421 0.874396 0.020393 O\n0.190579 0.874396 0.520393 O\n0.690579 0.125604 0.979607 O\n0.809421 0.125604 0.479607 O\n0.305086 0.637968 0.375570 O\n0.194914 0.637968 0.875570 O\n0.694914 0.362032 0.624430 O\n0.805086 0.362032 0.124430 O\n0.296608 0.369848 0.257940 O\n0.203392 0.369848 0.757940 O\n0.703392 0.630152 0.742060 O\n0.796608 0.630152 0.242060 O\n",
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{
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"structure_string": "Al4 Si4 H8 O18\n1.0\n-5.212979 0.000000 0.000000\n1.932443 7.224809 0.000000\n-0.042961 -0.280717 -9.047093\nAl Si H O\n4 4 8 18\ndirect\n0.640626 0.542793 0.507074 Al\n0.644443 0.541737 0.171261 Al\n0.137107 0.539777 0.007387 Al\n0.147963 0.545653 0.671339 Al\n0.941006 0.927865 0.662782 Si\n0.927750 0.924554 0.334130 Si\n0.441988 0.925202 0.162416 Si\n0.426236 0.925747 0.834223 Si\n0.795172 0.690050 0.939553 H\n0.879551 0.288017 0.828495 H\n0.899274 0.292746 0.496214 H\n0.888179 0.286318 0.183312 H\n0.304397 0.704687 0.442197 H\n0.383415 0.285907 0.332418 H\n0.386236 0.285145 0.001776 H\n0.394939 0.292721 0.686071 H\n0.889713 0.704860 0.647967 O\n0.815487 0.701836 0.338169 O\n0.939496 0.020754 0.500746 O\n0.727621 0.997841 0.768556 O\n0.736700 0.018950 0.235595 O\n0.387339 0.701986 0.147585 O\n0.316423 0.702880 0.838783 O\n0.437666 0.019998 0.001606 O\n0.230430 0.994644 0.269970 O\n0.234210 0.021472 0.737634 O\n0.887303 0.690138 0.032961 O\n0.983860 0.415890 0.834314 O\n0.903165 0.417865 0.530146 O\n0.895966 0.405907 0.142089 O\n0.393546 0.695531 0.534790 O\n0.483704 0.414782 0.335950 O\n0.397614 0.413162 0.030877 O\n0.400473 0.410581 0.642613 O\n",
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"elements": [
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],
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"formula_full": "Al4 Si4 H8 O18",
"formula_reduced": "Al2Si2H4O9",
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{
"id": "mp-1198588",
"created_at": "2022-09-04T14:48:19.940387Z",
"structure_string": "Al4 Si4 H8 O18\n1.0\n4.524838 2.616340 0.000000\n4.524838 -2.616340 0.000000\n2.385638 0.000000 -14.711055\nAl Si H O\n4 4 8 18\ndirect\n0.398761 0.266863 0.497996 Al\n0.266863 0.398761 0.997996 Al\n0.737220 0.599515 0.497852 Al\n0.599515 0.737220 0.997852 Al\n0.783162 0.345572 0.311453 Si\n0.345572 0.783162 0.811453 Si\n0.469772 0.002258 0.310428 Si\n0.002258 0.469772 0.810428 Si\n0.097617 0.743803 0.411437 H\n0.743803 0.097617 0.911437 H\n0.186820 0.028545 0.116168 H\n0.028545 0.186820 0.616168 H\n0.892290 0.686837 0.126922 H\n0.686837 0.892290 0.626922 H\n0.581187 0.346796 0.121737 H\n0.346796 0.581187 0.621737 H\n0.134121 0.138063 0.280107 O\n0.138063 0.134121 0.780107 O\n0.675507 0.683731 0.264875 O\n0.683731 0.675507 0.764875 O\n0.607736 0.216501 0.263877 O\n0.216501 0.607736 0.763877 O\n0.704392 0.342001 0.420619 O\n0.342001 0.704392 0.920619 O\n0.479896 0.955593 0.420206 O\n0.955593 0.479896 0.920206 O\n0.089406 0.560460 0.423436 O\n0.560460 0.089406 0.923436 O\n0.049277 0.306286 0.563181 O\n0.306286 0.049277 0.063181 O\n0.661660 0.917706 0.562222 O\n0.917706 0.661660 0.062222 O\n0.440776 0.527268 0.561183 O\n0.527268 0.440776 0.061183 O\n",
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"formula_full": "Al4 Si4 H8 O18",
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"updated_at": "2021-11-28T01:38:56.281000Z",
"spacegroup": 9
},
{
"id": "mp-1105589",
"created_at": "2022-09-04T14:42:46.840233Z",
"structure_string": "Al2 Si2 H4 O9\n1.0\n-2.635751 -4.565254 -0.035790\n-2.602802 4.546231 0.017895\n-0.025232 -0.043703 -7.296456\nAl Si H O\n2 2 4 9\ndirect\n0.667463 0.667447 0.481588 Al\n0.000016 0.332553 0.481588 Al\n0.677979 0.342267 0.855916 Si\n0.335712 0.657733 0.855916 Si\n0.341289 0.341238 0.226995 H\n0.000051 0.658762 0.226995 H\n0.658758 0.000000 0.228464 H\n0.996284 0.000000 0.752355 H\n0.712652 0.386572 0.636807 O\n0.326080 0.613428 0.636807 O\n0.500086 0.494611 0.949471 O\n0.005475 0.505389 0.949471 O\n0.504734 0.000000 0.929238 O\n0.335518 0.393557 0.353591 O\n0.941961 0.606443 0.353591 O\n0.728656 0.000000 0.349955 O\n0.933983 0.000000 0.628854 O\n",
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{
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"created_at": "2022-09-04T14:43:55.556755Z",
"structure_string": "Al4 Si4 H8 O18\n1.0\n3.882908 2.696075 -2.517409\n-3.882908 2.696075 2.517409\n-0.284251 0.000000 22.807234\nAl Si H O\n4 4 8 18\ndirect\n0.751352 0.478626 0.708502 Al\n0.521374 0.248648 0.208502 Al\n0.101358 0.196289 0.702739 Al\n0.803711 0.898642 0.202739 Al\n0.794564 0.392179 0.525871 Si\n0.607821 0.205436 0.025871 Si\n0.458339 0.746583 0.522859 Si\n0.253417 0.541661 0.022859 Si\n0.689412 0.910877 0.612995 H\n0.089123 0.310588 0.112995 H\n0.604054 0.948924 0.879029 H\n0.051076 0.395946 0.379029 H\n0.743575 0.914359 0.890762 H\n0.085641 0.256425 0.390762 H\n0.599450 0.685124 0.786816 H\n0.314876 0.400550 0.286816 H\n0.579962 0.116933 0.490317 O\n0.883067 0.420038 0.990317 O\n0.089965 0.602989 0.498176 O\n0.397011 0.910035 0.998176 O\n0.598095 0.598967 0.503296 O\n0.401033 0.401905 0.003296 O\n0.887622 0.224903 0.610565 O\n0.775097 0.112378 0.110565 O\n0.586577 0.689129 0.610189 O\n0.310871 0.413423 0.110189 O\n0.811951 0.701135 0.800673 O\n0.298865 0.188049 0.300673 O\n0.833380 0.807175 0.730162 O\n0.192825 0.166620 0.230162 O\n0.448819 0.177378 0.728274 O\n0.822622 0.551181 0.228274 O\n0.081343 0.453248 0.722975 O\n0.546752 0.918657 0.222975 O\n",
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{
"id": "mp-1183270",
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"structure_string": "Al2 Si2 H4 O9\n1.0\n4.509579 2.624023 0.000000\n-4.509579 2.624023 0.000000\n0.000000 0.229061 7.133833\nAl Si H O\n2 2 4 9\ndirect\n0.341140 0.012118 0.517760 Al\n0.012118 0.341140 0.517760 Al\n0.321997 0.663313 0.129087 Si\n0.663313 0.321997 0.129087 Si\n0.883316 0.883316 0.354258 H\n0.396198 0.396198 0.760325 H\n0.658502 0.013035 0.778619 H\n0.013035 0.658502 0.778619 H\n0.507499 0.996689 0.033919 O\n0.996689 0.507499 0.033919 O\n0.494130 0.494130 0.051484 O\n0.675040 0.297359 0.354955 O\n0.297359 0.675040 0.354955 O\n0.067692 0.067692 0.364626 O\n0.669510 0.053417 0.643830 O\n0.053417 0.669510 0.643830 O\n0.282345 0.282345 0.655366 O\n",
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{
"id": "mp-720262",
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"structure_string": "Al4 Si4 H8 O18\n1.0\n2.717387 4.531808 0.000000\n-2.717387 4.531808 0.000000\n0.000000 1.631836 18.431648\nAl Si H O\n4 4 8 18\ndirect\n0.155968 0.461342 0.255032 Al\n0.461342 0.155968 0.755032 Al\n0.936127 0.058375 0.314681 Al\n0.058375 0.936127 0.814681 Al\n0.900454 0.227027 0.483696 Si\n0.227027 0.900454 0.983696 Si\n0.257170 0.584466 0.486553 Si\n0.584466 0.257170 0.986553 Si\n0.519376 0.539024 0.385657 H\n0.539024 0.519376 0.885657 H\n0.595300 0.819591 0.132047 H\n0.819591 0.595300 0.632047 H\n0.950027 0.507144 0.096251 H\n0.507144 0.950027 0.596251 H\n0.470901 0.924257 0.155040 H\n0.924257 0.470901 0.655040 H\n0.574155 0.402837 0.522006 O\n0.402837 0.574155 0.022006 O\n0.058598 0.899386 0.521383 O\n0.899386 0.058598 0.021383 O\n0.089885 0.391458 0.495988 O\n0.391458 0.089885 0.995988 O\n0.854292 0.224465 0.397932 O\n0.224465 0.854292 0.897932 O\n0.314318 0.660409 0.400029 O\n0.660409 0.314318 0.900029 O\n0.495258 0.429702 0.207422 O\n0.429702 0.495258 0.707422 O\n0.542531 0.331759 0.279000 O\n0.331759 0.542531 0.779000 O\n0.905127 0.765891 0.292233 O\n0.765891 0.905127 0.792233 O\n0.126692 0.160087 0.250851 O\n0.160087 0.126692 0.750851 O\n",
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"formula_full": "Al4 Si4 H8 O18",
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{
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{
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}