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{
"id": "jvasp-116628",
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"updated_at": "2022-09-04T14:38:44.590265Z",
"structure_string": "Ba2 Yb2 Al6 Si2 N8 O6\n1.0\n6.155226 -0.000000 0.000000\n-3.077613 5.330582 0.000000\n-0.000000 -0.000000 10.165202\nYb Ba Al Si N O\n2 2 6 2 8 6\ndirect\n0.666667 0.333333 0.925364 Yb\n0.333334 0.666666 0.425364 Yb\n0.666667 0.333333 0.551390 Ba\n0.333334 0.666666 0.051391 Ba\n0.165792 0.331584 0.741214 Al\n0.165793 0.834208 0.741214 Al\n0.834209 0.668415 0.241214 Al\n0.668416 0.834208 0.741214 Al\n0.834208 0.165792 0.241214 Al\n0.331585 0.165792 0.241214 Al\n0.000000 0.000000 0.000661 Si\n0.000000 0.000000 0.500661 Si\n0.000000 0.000000 0.321757 N\n0.000000 0.000000 0.821757 N\n0.301658 0.150829 0.060519 N\n0.849172 0.150829 0.060519 N\n0.150829 0.301657 0.560519 N\n0.849172 0.698342 0.060519 N\n0.150829 0.849171 0.560519 N\n0.698343 0.849171 0.560519 N\n0.512222 0.487779 0.292978 O\n0.487779 0.975557 0.792978 O\n0.487779 0.512221 0.792978 O\n0.512222 0.024442 0.292978 O\n0.024443 0.512221 0.792978 O\n0.975558 0.487779 0.292978 O\n",
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{
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"structure_string": "Li1 Mg1 H14 Cl3 O7\n1.0\n6.533274 0.020310 0.198452\n0.221460 6.532541 0.271010\n-0.010103 0.062750 6.742811\nLi Mg H Cl O\n1 1 14 3 7\ndirect\n0.568219 0.563998 0.582003 Li\n0.150978 0.154642 0.149390 Mg\n0.709917 0.874679 0.722629 H\n0.883342 0.702556 0.719237 H\n0.114807 0.792087 0.346085 H\n0.346922 0.122559 0.796050 H\n0.117154 0.378377 0.489048 H\n0.386965 0.499224 0.116313 H\n0.790981 0.367455 0.114234 H\n0.918873 0.803003 0.215562 H\n0.800548 0.230361 0.927537 H\n0.213896 0.927633 0.810069 H\n0.940941 0.220982 0.498472 H\n0.228175 0.512629 0.942790 H\n0.505298 0.931153 0.228422 H\n0.496445 0.112209 0.373931 H\n0.212619 0.648590 0.638374 Cl\n0.642078 0.628168 0.242973 Cl\n0.637574 0.206029 0.648926 Cl\n0.866078 0.251248 0.053902 O\n0.437645 0.065621 0.252135 O\n0.262893 0.437955 0.068188 O\n0.071597 0.253779 0.430133 O\n0.734223 0.725333 0.734118 O\n0.229035 0.061183 0.867620 O\n0.051954 0.865804 0.231112 O\n",
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{
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"updated_at": "2022-09-04T14:38:44.620979Z",
"structure_string": "Al16 V10\n1.0\n7.573287 -0.011469 2.568369\n-3.798372 6.551884 2.568369\n0.001628 0.002821 7.927644\nAl V\n16 10\ndirect\n0.642106 0.382175 0.350652 Al\n0.356405 0.356404 0.998873 Al\n0.002469 0.647528 0.353911 Al\n0.644814 0.644813 0.998884 Al\n0.007690 0.742409 0.646701 Al\n0.245620 0.245619 0.414795 Al\n0.742410 0.007690 0.646700 Al\n0.610307 0.253824 0.736373 Al\n0.647529 0.002469 0.353911 Al\n0.357709 0.008760 0.261713 Al\n0.008760 0.357709 0.261713 Al\n0.764262 0.349735 0.983462 Al\n0.253825 0.610306 0.736373 Al\n0.382176 0.642105 0.350652 Al\n0.654709 0.654709 0.597631 Al\n0.349735 0.764261 0.983462 Al\n0.004608 0.200665 0.004069 V\n0.791288 0.791287 0.205695 V\n0.342585 0.003012 0.645339 V\n0.003012 0.342584 0.645339 V\n0.990945 0.660386 0.007036 V\n0.660387 0.990944 0.007036 V\n0.340781 0.340780 0.667290 V\n0.200666 0.004608 0.004069 V\n0.002132 0.002132 0.333270 V\n0.993079 0.993078 0.805051 V\n",
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{
"id": "jvasp-116607",
"created_at": "2022-09-04T14:38:44.267180Z",
"updated_at": "2022-09-04T14:38:44.267210Z",
"structure_string": "Na2 Fe4 Pb2 F18\n1.0\n7.135892 -0.090875 0.167890\n-3.518692 6.208705 0.167890\n-0.049986 -0.084543 7.640801\nNa Fe Pb F\n2 4 2 18\ndirect\n0.500000 -0.000000 0.000000 Na\n-0.000000 0.500000 0.500000 Na\n-0.000000 0.000000 0.500000 Fe\n0.000000 0.000000 0.000000 Fe\n0.500000 -0.000000 0.500000 Fe\n-0.000000 0.500000 0.000000 Fe\n0.472894 0.527105 0.750000 Pb\n0.527105 0.472894 0.250000 Pb\n0.305960 0.223539 0.983879 F\n0.694039 0.776460 0.016120 F\n0.274820 0.582290 0.075129 F\n0.725179 0.417709 0.924870 F\n0.417709 0.725179 0.424871 F\n0.582290 0.274820 0.575129 F\n0.907463 0.524769 0.222400 F\n0.092537 0.475230 0.777600 F\n0.970362 0.029636 0.750000 F\n0.524769 0.907462 0.722400 F\n0.029637 0.970362 0.250000 F\n0.223538 0.305960 0.483880 F\n0.897175 0.206284 0.050275 F\n0.102824 0.793715 0.949725 F\n0.793715 0.102823 0.449725 F\n0.206284 0.897175 0.550275 F\n0.475230 0.092537 0.277600 F\n0.776461 0.694038 0.516120 F\n",
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{
"id": "jvasp-113063",
"created_at": "2022-09-04T14:38:44.423854Z",
"updated_at": "2022-09-04T14:38:44.423884Z",
"structure_string": "Rb2 Al2 Si6 O16\n1.0\n7.741951 -0.049935 1.952633\n-3.639965 6.833078 1.952633\n0.021079 0.034856 7.200275\nRb Al Si O\n2 2 6 16\ndirect\n0.286071 0.297962 0.855782 Rb\n0.702038 0.713929 0.144216 Rb\n0.596503 0.834180 0.659533 Al\n0.165820 0.403497 0.340465 Al\n0.800305 0.178731 0.224552 Si\n0.196872 0.811883 0.780146 Si\n0.188117 0.803128 0.219853 Si\n0.400199 0.160070 0.341978 Si\n0.839929 0.599801 0.658020 Si\n0.821269 0.199695 0.775447 Si\n0.968451 0.705885 0.405529 O\n0.337795 0.713977 0.748267 O\n0.738212 0.360015 0.733351 O\n0.353089 0.339604 0.279243 O\n0.660396 0.646911 0.720756 O\n0.706808 0.957582 0.391401 O\n0.294115 0.031548 0.594470 O\n0.326459 0.019179 0.215768 O\n0.152168 0.847832 -0.000000 O\n0.842345 0.157654 -0.000000 O\n0.007576 0.333790 0.213792 O\n0.286023 0.662205 0.251732 O\n0.980820 0.673541 0.784231 O\n0.666210 -0.007576 0.786207 O\n0.042418 0.293191 0.608597 O\n0.639985 0.261788 0.266648 O\n",
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{
"id": "jvasp-54752",
"created_at": "2022-09-04T14:38:34.494092Z",
"updated_at": "2022-09-04T14:38:34.494112Z",
"structure_string": "Ta4 H8 O14\n1.0\n5.187499 5.187492 -0.000000\n0.000001 5.187491 5.187489\n5.187499 0.000000 5.187491\nTa H O\n4 8 14\ndirect\n0.500000 -0.000000 0.500000 Ta\n0.500000 0.500001 0.000000 Ta\n-0.000000 0.500000 0.499999 Ta\n0.500000 0.500000 0.500001 Ta\n0.066282 0.301154 0.066283 H\n0.301155 0.066282 0.066282 H\n0.066282 0.066283 0.301154 H\n0.066283 0.066282 0.066282 H\n0.933718 0.933718 0.933718 H\n0.698846 0.933718 0.933719 H\n0.933718 0.698846 0.933719 H\n0.933718 0.933718 0.698847 H\n0.822748 0.427250 0.427252 O\n0.427252 0.822747 0.427253 O\n0.822747 0.427253 0.822747 O\n0.427252 0.427252 0.822749 O\n0.822748 0.822747 0.427253 O\n0.427250 0.822749 0.822749 O\n0.572748 0.177251 0.177252 O\n0.177252 0.572747 0.177252 O\n0.572747 0.572748 0.177253 O\n0.177252 0.177250 0.572749 O\n0.177252 0.572748 0.572748 O\n0.875000 0.875000 0.875001 O\n0.572747 0.177251 0.572749 O\n0.124999 0.125000 0.125000 O\n",
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{
"id": "jvasp-116804",
"created_at": "2022-09-04T14:38:44.885411Z",
"updated_at": "2022-09-04T14:38:44.885444Z",
"structure_string": "K6 Mo4 Br2 O14\n1.0\n5.960996 0.000000 0.000000\n-2.980498 5.162374 0.000000\n-0.000000 -0.000000 15.671561\nK Mo Br O\n6 4 2 14\ndirect\n0.666667 0.333333 0.457975 K\n0.333333 0.666666 0.542025 K\n0.333333 0.666666 0.957975 K\n0.666667 0.333333 0.750000 K\n0.666667 0.333333 0.042025 K\n0.333333 0.666666 0.250000 K\n0.000000 0.000000 0.870219 Mo\n0.000000 0.000000 0.629781 Mo\n0.000000 0.000000 0.370219 Mo\n0.000000 0.000000 0.129781 Mo\n0.666667 0.333333 0.250000 Br\n0.333333 0.666666 0.750000 Br\n0.317280 0.158641 0.908962 O\n0.841359 0.682719 0.591037 O\n0.158641 0.317280 0.091038 O\n0.000000 0.000000 0.750000 O\n0.682720 0.841359 0.091038 O\n0.682720 0.841359 0.408962 O\n0.841360 0.158641 0.591037 O\n0.158640 0.841359 0.091038 O\n0.158641 0.317280 0.408962 O\n0.841359 0.682719 0.908962 O\n0.158640 0.841359 0.408962 O\n0.000000 0.000000 0.250000 O\n0.317280 0.158641 0.591037 O\n0.841360 0.158641 0.908962 O\n",
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],
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{
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"structure_string": "Ca10 Co4 N12\n1.0\n5.689586 0.000543 -1.049648\n-3.358270 5.189481 -0.000000\n-0.025403 -0.016439 12.441819\nCa Co N\n10 4 12\ndirect\n0.000000 0.368700 0.750000 Ca\n0.000000 0.631299 0.250000 Ca\n0.128077 0.803822 0.999356 Ca\n0.871923 0.675746 0.500644 Ca\n0.871923 0.196177 0.000644 Ca\n0.128077 0.324253 0.499356 Ca\n0.319240 0.051323 0.723861 Ca\n0.680761 0.732083 0.776139 Ca\n0.680761 0.948676 0.276139 Ca\n0.319240 0.267916 0.223861 Ca\n0.542852 0.659692 0.064659 Co\n0.457149 0.116841 0.435341 Co\n0.542852 0.883157 0.564659 Co\n0.457149 0.340307 0.935341 Co\n0.105110 0.014452 0.371263 N\n0.286644 0.676023 0.644392 N\n0.713357 0.389380 0.855608 N\n0.713357 0.323976 0.355608 N\n0.286644 0.610619 0.144392 N\n0.569142 0.233474 0.575204 N\n0.430859 0.664332 0.924796 N\n0.430859 0.766525 0.424796 N\n0.569142 0.335667 0.075204 N\n0.894891 0.985547 0.628737 N\n0.105110 0.090657 0.871263 N\n0.894891 0.909342 0.128737 N\n",
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{
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"structure_string": "Li2 Fe2 Si6 O16\n1.0\n7.142568 0.041157 -2.539487\n4.041670 6.427862 0.813006\n-0.028988 -0.070483 7.010916\nLi Fe Si O\n2 2 6 16\ndirect\n0.261430 0.716595 0.157359 Li\n0.738569 0.283405 0.842642 Li\n0.463615 0.788625 0.629206 Fe\n0.536385 0.211376 0.370795 Fe\n0.768917 0.426609 0.290839 Si\n0.832964 0.793304 0.240458 Si\n0.141291 0.148295 0.195165 Si\n0.858709 0.851705 0.804835 Si\n0.231083 0.573391 0.709161 Si\n0.167036 0.206697 0.759542 Si\n0.246782 0.278736 0.294228 O\n0.936550 0.333678 0.542623 O\n0.713377 0.098771 0.672486 O\n0.912581 0.831400 0.057288 O\n0.535450 0.451946 0.263237 O\n0.725915 0.651168 0.187586 O\n0.753218 0.721264 0.705773 O\n0.063450 0.666322 0.457378 O\n0.464550 0.548054 0.736764 O\n0.087419 0.168600 0.942713 O\n0.286623 0.901229 0.327514 O\n0.655884 0.011702 0.250135 O\n0.344115 0.988299 0.749866 O\n0.117664 0.738932 0.830042 O\n0.274085 0.348832 0.812414 O\n0.882335 0.261069 0.169958 O\n",
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{
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"created_at": "2022-09-04T14:38:47.207985Z",
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"structure_string": "Li2 V4 Si4 O16\n1.0\n4.787865 -0.011703 -0.000027\n0.027185 5.715154 0.000013\n0.000033 0.000010 10.028113\nLi V Si O\n2 4 4 16\ndirect\n0.250000 0.250056 0.298208 Li\n0.750006 0.749952 0.798216 Li\n0.753031 0.490789 0.063957 V\n0.246971 0.509210 0.563957 V\n0.746959 0.009205 0.532483 V\n0.253043 0.990794 0.032484 V\n0.689169 0.508383 0.390550 Si\n0.310833 0.491618 0.890550 Si\n0.189160 0.008401 0.705885 Si\n0.810842 0.991600 0.205886 Si\n0.466360 0.279732 0.977996 O\n0.416056 0.501009 0.736593 O\n0.583941 0.498989 0.236594 O\n0.476325 0.712044 0.969074 O\n0.523678 0.287954 0.469075 O\n0.533642 0.720266 0.477995 O\n0.966373 0.779713 0.118439 O\n0.916025 0.000984 0.359845 O\n0.023676 0.787965 0.627359 O\n0.976325 0.212035 0.127360 O\n0.083974 -0.000984 0.859845 O\n0.975411 0.504266 0.905503 O\n0.475419 0.004255 0.190923 O\n0.524581 0.995745 0.690924 O\n0.033629 0.220285 0.618439 O\n0.024588 0.495735 0.405503 O\n",
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{
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