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{
"id": "jvasp-35355",
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"structure_string": "Mg2 Si4\n1.0\n-3.917375 -0.000000 0.000000\n-1.958688 -3.269251 4.090656\n-1.958688 3.269251 4.090656\nMg Si\n2 4\ndirect\n0.416848 0.333153 0.833152 Mg\n0.583151 0.666848 0.166848 Mg\n0.853309 0.088410 0.204972 Si\n0.146690 0.911591 0.795029 Si\n0.853309 0.704973 0.588410 Si\n0.146690 0.295028 0.411591 Si\n",
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{
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{
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"structure_string": "Li2 Cr1 Cl4\n1.0\n3.707097 0.047818 -0.152039\n-0.347766 5.887880 -1.875130\n0.058982 -0.005680 6.188752\nLi Cr Cl\n2 1 4\ndirect\n0.500000 0.000000 0.500000 Li\n0.500000 0.500000 -0.000000 Li\n0.000000 0.000000 0.000000 Cr\n0.547120 0.753855 0.753855 Cl\n-0.000001 0.759433 0.240567 Cl\n0.452879 0.246145 0.246145 Cl\n-0.000001 0.240567 0.759433 Cl\n",
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{
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"updated_at": "2022-09-04T14:36:16.262905Z",
"structure_string": "Na4 Ni2 H16 S4 O24\n1.0\n5.388453 0.000000 -0.915951\n0.000000 8.097132 0.000000\n-0.005379 0.000000 11.006291\nNa Ni H S O\n4 2 16 4 24\ndirect\n0.878946 0.924315 0.636495 Na\n0.121053 0.424315 0.863505 Na\n0.121053 0.075685 0.363505 Na\n0.878946 0.575685 0.136495 Na\n0.000000 0.000000 0.000000 Ni\n-0.000000 0.500000 0.500000 Ni\n0.769327 0.556741 0.679981 H\n0.769327 0.943259 0.179981 H\n0.230672 0.443259 0.320019 H\n0.215363 0.859425 0.842286 H\n0.784636 0.359425 0.657714 H\n0.784636 0.140575 0.157714 H\n0.674158 0.192487 0.862459 H\n0.325842 0.692487 0.637541 H\n0.230672 0.056741 0.820019 H\n0.674158 0.307513 0.362459 H\n0.325842 0.807513 0.137541 H\n0.235766 0.778096 0.510806 H\n0.764233 0.278096 0.989194 H\n0.215363 0.640575 0.342286 H\n0.764233 0.221904 0.489194 H\n0.235766 0.721904 0.010806 H\n0.619186 0.714383 0.863606 S\n0.380813 0.214384 0.636394 S\n0.380813 0.285616 0.136394 S\n0.619186 0.785616 0.363606 S\n0.353865 0.672469 0.870256 O\n0.637944 0.730368 0.729583 O\n0.362055 0.230368 0.770417 O\n0.362055 0.269632 0.270417 O\n0.637944 0.769632 0.229583 O\n0.785709 0.583684 0.920634 O\n0.214290 0.083684 0.579366 O\n0.214290 0.416316 0.079366 O\n0.785710 0.916316 0.420634 O\n0.673435 0.874983 0.927780 O\n0.326564 0.374983 0.572220 O\n0.173224 0.785324 0.076728 O\n0.826776 0.285324 0.423272 O\n0.826776 0.214676 0.923272 O\n0.173224 0.714676 0.576728 O\n0.117465 0.535625 0.334927 O\n0.882534 0.035625 0.165073 O\n0.882534 0.464375 0.665073 O\n0.117465 0.964375 0.834927 O\n0.353865 0.827530 0.370256 O\n0.326564 0.125017 0.072220 O\n0.646134 0.172469 0.629744 O\n0.673435 0.625017 0.427780 O\n0.646134 0.327531 0.129744 O\n",
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{
"id": "jvasp-103162",
"created_at": "2022-09-04T14:36:44.316672Z",
"updated_at": "2022-09-04T14:36:44.316693Z",
"structure_string": "K2 Rb1 Er1 Cl6\n1.0\n6.875513 0.000000 3.969579\n2.291838 6.482295 3.969579\n-0.000000 0.000000 7.939159\nK Rb Er Cl\n2 1 1 6\ndirect\n0.750000 0.750001 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Er\n0.769338 0.230662 0.230662 Cl\n0.230661 0.230662 0.769339 Cl\n0.230661 0.769339 0.769339 Cl\n0.230661 0.769339 0.230661 Cl\n0.769338 0.230662 0.769339 Cl\n0.769338 0.769339 0.230661 Cl\n",
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{
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"created_at": "2022-09-04T14:38:41.609850Z",
"updated_at": "2022-09-04T14:38:41.609872Z",
"structure_string": "Ba1 Br1 N1\n1.0\n4.569725 0.000000 -0.000000\n0.000000 4.569725 0.000000\n-0.000000 -0.000000 7.206624\nBa Br N\n1 1 1\ndirect\n0.000000 0.000000 0.304843 Ba\n0.000000 0.000000 0.735197 Br\n0.000000 0.000000 -0.010316 N\n",
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{
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"created_at": "2022-09-04T14:36:54.546326Z",
"updated_at": "2022-09-04T14:36:54.546348Z",
"structure_string": "Na4 Cr2 Cl8\n1.0\n0.000000 3.937479 -0.056461\n11.466731 0.000000 0.000000\n0.000000 -0.350814 -6.907731\nNa Cr Cl\n4 2 8\ndirect\n0.517553 0.818968 0.404566 Na\n0.482447 0.318968 0.095433 Na\n0.482448 0.181032 0.595433 Na\n0.517554 0.681032 0.904566 Na\n0.000000 0.000000 0.000000 Cr\n0.000001 0.500000 0.500000 Cr\n0.012801 0.803593 0.114059 Cl\n0.987199 0.303593 0.385941 Cl\n0.987200 0.196407 0.885941 Cl\n0.012802 0.696407 0.614059 Cl\n0.433208 0.047699 0.243066 Cl\n0.566793 0.547699 0.256933 Cl\n0.566793 0.952301 0.756933 Cl\n0.433208 0.452301 0.743066 Cl\n",
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{
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"structure_string": "K8 V4 O18\n1.0\n8.108066 -0.024275 0.000000\n-0.933109 8.054231 0.000000\n-0.000000 -0.000000 8.019090\nK V O\n8 4 18\ndirect\n0.463106 0.536894 0.250000 K\n0.536894 0.463106 0.750000 K\n0.987533 0.012467 0.250000 K\n0.012467 0.987533 0.750000 K\n0.905146 0.540848 0.250000 K\n0.540848 0.905146 0.750000 K\n0.094854 0.459152 0.750000 K\n0.459152 0.094854 0.250000 K\n0.774639 0.225361 0.977064 V\n0.225361 0.774638 0.022936 V\n0.774639 0.225361 0.522936 V\n0.225361 0.774638 0.477064 V\n0.321605 0.164419 0.750000 O\n0.164419 0.321605 0.250000 O\n0.768613 0.231387 0.750000 O\n0.231387 0.768613 0.250000 O\n0.645401 0.354599 0.057166 O\n0.354599 0.645400 0.942834 O\n0.645401 0.354599 0.442834 O\n0.354599 0.645400 0.557166 O\n0.024666 0.716371 0.963565 O\n0.975335 0.283628 0.036435 O\n0.283629 0.975334 0.536435 O\n0.975335 0.283628 0.463565 O\n0.716371 0.024665 0.036435 O\n0.835581 0.678395 0.750000 O\n0.716371 0.024665 0.463565 O\n0.024666 0.716371 0.536435 O\n0.283629 0.975334 0.963565 O\n0.678395 0.835580 0.250000 O\n",
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{
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"structure_string": "Li4 Al4 Si4 O16\n1.0\n4.953094 0.000000 0.000000\n0.000000 6.582106 0.000000\n0.000000 0.000000 10.059460\nLi Al Si O\n4 4 4 16\ndirect\n0.255991 0.988741 0.350979 Li\n0.755991 0.488741 0.149021 Li\n0.755991 0.011260 0.649021 Li\n0.255991 0.511260 0.850979 Li\n0.751718 0.510799 0.672681 Al\n0.251719 0.010799 0.827319 Al\n0.251719 0.489202 0.327319 Al\n0.751718 0.989202 0.172681 Al\n0.750801 0.726936 0.408780 Si\n0.750801 0.773065 0.908780 Si\n0.250802 0.226936 0.091220 Si\n0.250802 0.273064 0.591220 Si\n0.313116 0.226772 0.931167 O\n0.358325 0.061840 0.661339 O\n0.858325 0.938160 0.338661 O\n0.358325 0.438160 0.161339 O\n0.313116 0.273228 0.431167 O\n0.858325 0.561841 0.838661 O\n0.400324 0.461919 0.668712 O\n0.900323 0.961919 0.831288 O\n0.813116 0.726772 0.568833 O\n0.900323 0.538081 0.331288 O\n0.424122 0.710704 0.380177 O\n0.924122 0.289297 0.619823 O\n0.924122 0.210704 0.119823 O\n0.400324 0.038081 0.168712 O\n0.424122 0.789297 0.880177 O\n0.813116 0.773229 0.068833 O\n",
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"structure_string": "Na10 P6 O20\n1.0\n5.353757 0.000000 0.000000\n-2.676878 4.812385 -0.591259\n0.000000 -0.029111 18.579581\nNa P O\n10 6 20\ndirect\n0.346837 0.652353 0.067013 Na\n0.889667 0.928296 0.824542 Na\n0.461372 0.071706 0.675458 Na\n0.194485 0.347648 0.432987 Na\n0.653164 0.347648 0.932987 Na\n0.538629 0.928295 0.324542 Na\n0.000000 0.000000 0.000000 Na\n0.110334 0.071706 0.175458 Na\n0.805516 0.652353 0.567013 Na\n0.500000 0.000000 0.500000 Na\n0.144688 0.336153 0.598714 P\n0.691465 0.336153 0.098714 P\n0.101108 0.500001 0.750000 P\n0.898893 0.500001 0.250000 P\n0.308535 0.663848 0.901285 P\n0.855313 0.663848 0.401286 P\n0.830845 0.248810 0.766643 O\n0.738697 0.584168 0.313811 O\n0.756948 0.594482 0.062883 O\n0.662466 0.405519 0.437117 O\n0.917966 0.248810 0.266644 O\n0.935224 0.267871 0.097115 O\n0.167352 0.732130 0.402885 O\n0.337535 0.594482 0.562883 O\n0.601859 0.909812 0.924894 O\n0.261304 0.415833 0.686189 O\n0.398142 0.090189 0.075106 O\n0.807955 0.909812 0.424894 O\n0.082035 0.751191 0.733356 O\n0.192046 0.090189 0.575106 O\n0.243053 0.405519 0.937117 O\n0.169155 0.751191 0.233356 O\n0.654530 0.415833 0.186189 O\n0.832649 0.267871 0.597115 O\n0.064777 0.732130 0.902884 O\n0.345471 0.584168 0.813811 O\n",
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{
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"structure_string": "Na4 C1 O4\n1.0\n4.768709 0.211869 -0.270505\n-0.298153 4.764326 -0.270314\n0.190566 0.212250 4.772780\nNa C O\n4 1 4\ndirect\n0.985205 0.535198 0.535268 Na\n0.535155 0.535230 0.985226 Na\n0.197895 0.198025 0.198185 Na\n0.535269 0.985212 0.535157 Na\n0.910674 0.910637 0.910597 C\n0.022740 0.690807 0.022694 O\n0.690870 0.022750 0.022703 O\n0.022732 0.022686 0.690717 O\n0.481676 0.481670 0.481670 O\n",
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{
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"created_at": "2022-09-04T14:37:40.163041Z",
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"structure_string": "Rb6 Pr2\n1.0\n4.494814 -7.785246 -0.000000\n4.494814 7.785246 0.000000\n0.000000 0.000000 7.385742\nRb Pr\n6 2\ndirect\n0.172188 0.827812 0.750000 Rb\n0.655623 0.827811 0.750000 Rb\n0.172188 0.344376 0.750000 Rb\n0.827812 0.172188 0.250000 Rb\n0.344376 0.172188 0.250000 Rb\n0.827811 0.655623 0.250000 Rb\n0.333333 0.666667 0.250000 Pr\n0.666667 0.333333 0.750000 Pr\n",
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}