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{
"id": "jvasp-97646",
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"structure_string": "Ce2 Te6\n1.0\n4.377101 0.000000 -0.736994\n0.000000 4.440344 0.000000\n-0.050992 0.000000 13.063734\nCe Te\n2 6\ndirect\n0.088870 0.749999 0.336007 Ce\n0.752864 0.250000 0.663993 Ce\n0.993085 0.250000 0.144398 Te\n0.493313 0.749999 0.144858 Te\n0.624903 0.250000 0.408080 Te\n0.848687 0.749999 0.855602 Te\n0.348456 0.250000 0.855142 Te\n0.216823 0.749999 0.591920 Te\n",
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{
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"structure_string": "Hg2 H32 Br12 N8\n1.0\n9.042498 0.000000 0.000000\n0.000000 9.040688 0.000000\n0.000000 0.000000 8.874063\nHg H Br N\n2 32 12 8\ndirect\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Hg\n0.255193 0.858404 0.308425 H\n0.642241 0.244786 0.808272 H\n0.142241 0.255215 0.308273 H\n0.441928 0.857290 0.674071 H\n0.142595 0.441961 0.326031 H\n0.244807 0.358404 0.808425 H\n0.857406 0.558039 0.326031 H\n0.357405 0.941961 0.826031 H\n0.357759 0.755215 0.808272 H\n0.755194 0.641596 0.808425 H\n0.857759 0.744786 0.691727 H\n0.857759 0.744786 0.308273 H\n0.558073 0.142711 0.325929 H\n0.941928 0.642711 0.174071 H\n0.142595 0.441961 0.673968 H\n0.558073 0.142711 0.674071 H\n0.744807 0.141596 0.691574 H\n0.941928 0.642711 0.825929 H\n0.357759 0.755215 0.191727 H\n0.744807 0.141596 0.308425 H\n0.755194 0.641596 0.191574 H\n0.255193 0.858404 0.691574 H\n0.142241 0.255215 0.691727 H\n0.642595 0.058039 0.826031 H\n0.244807 0.358404 0.191574 H\n0.642241 0.244786 0.191727 H\n0.441928 0.857290 0.325929 H\n0.857406 0.558039 0.673968 H\n0.642595 0.058039 0.173968 H\n0.357405 0.941961 0.173968 H\n0.058073 0.357290 0.825929 H\n0.058073 0.357290 0.174071 H\n0.823631 0.368170 0.500000 Br\n0.368215 0.176350 0.500000 Br\n0.000000 0.000000 0.705191 Br\n0.000000 0.000000 0.294808 Br\n0.676370 0.868170 0.000000 Br\n0.131785 0.676350 0.000000 Br\n0.631786 0.823650 0.500000 Br\n0.500000 0.500000 0.205191 Br\n0.868215 0.323650 0.000000 Br\n0.500000 0.500000 0.794808 Br\n0.176369 0.631830 0.500000 Br\n0.323631 0.131830 0.000000 Br\n0.853868 0.646003 0.750014 N\n0.353868 0.853997 0.749985 N\n0.146132 0.353997 0.750014 N\n0.146132 0.353997 0.249985 N\n0.646132 0.146003 0.749985 N\n0.353868 0.853997 0.250015 N\n0.853868 0.646003 0.249985 N\n0.646132 0.146003 0.250015 N\n",
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{
"id": "jvasp-9765",
"created_at": "2022-09-04T14:38:03.534232Z",
"updated_at": "2022-09-04T14:38:03.534242Z",
"structure_string": "Li3 Cd3 B3 O9\n1.0\n4.186701 -7.251580 0.000000\n4.186701 7.251580 -0.000000\n0.000000 -0.000000 3.267125\nLi Cd B O\n3 3 3 9\ndirect\n0.291047 0.007309 0.500001 Li\n0.716262 0.708953 0.500001 Li\n0.992691 0.283737 0.500001 Li\n0.631160 0.995642 0.000000 Cd\n0.004358 0.635519 0.000000 Cd\n0.364481 0.368839 0.000000 Cd\n0.666667 0.333333 0.500001 B\n0.333333 0.666667 0.500001 B\n0.000000 0.000000 0.000000 B\n0.857161 0.414828 0.500001 O\n0.188359 0.061773 0.000000 O\n0.938227 0.126587 0.000000 O\n0.873412 0.811641 0.000000 O\n0.246842 0.475377 0.500001 O\n0.228535 0.753158 0.500001 O\n0.524623 0.771465 0.500001 O\n0.585171 0.442333 0.500001 O\n0.557667 0.142838 0.500001 O\n",
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{
"id": "jvasp-97650",
"created_at": "2022-09-04T14:36:20.961294Z",
"updated_at": "2022-09-04T14:36:20.961321Z",
"structure_string": "H28 N4 O24\n1.0\n9.596275 0.000066 -0.014855\n0.001798 14.252735 -0.018568\n0.005491 0.003187 3.341468\nH N O\n28 4 24\ndirect\n0.497099 0.675721 0.027089 H\n0.737602 0.453661 0.834613 H\n0.689799 0.346758 0.867550 H\n0.658936 0.627559 0.998938 H\n0.874359 0.585161 0.915979 H\n0.809993 0.662084 0.620656 H\n0.127182 0.085184 0.583728 H\n0.191556 0.162062 0.879380 H\n0.342534 0.127619 0.500973 H\n0.311678 0.846715 0.632455 H\n0.131309 0.867709 0.261802 H\n0.263850 0.953621 0.665656 H\n0.566172 0.440758 0.273858 H\n0.410523 0.460950 0.404721 H\n0.870151 0.367782 0.238216 H\n0.019255 0.499980 0.353466 H\n0.894382 0.045012 0.489630 H\n-0.017808 -0.000074 0.146370 H\n0.590993 -0.039066 0.095439 H\n0.435377 0.940767 0.226487 H\n0.469626 0.071539 0.221654 H\n0.504327 0.175831 0.472951 H\n0.959863 0.821286 0.240857 H\n0.087794 0.792004 0.908215 H\n0.913714 0.292093 0.591581 H\n0.041608 0.321356 0.258838 H\n0.531904 0.571508 0.278531 H\n0.107149 0.544920 0.010221 H\n0.265011 0.337324 0.113295 N\n0.255707 0.675642 0.795403 N\n0.736466 0.837254 0.386569 N\n0.745760 0.175755 0.704265 N\n0.569732 0.638686 0.171615 O\n0.273735 0.900902 0.478522 O\n0.508405 0.482778 0.440608 O\n0.011435 0.527081 0.086192 O\n0.213767 0.103616 0.732922 O\n-0.009925 0.027137 0.413502 O\n0.493102 -0.017243 0.059642 O\n0.431754 0.138737 0.328402 O\n0.052432 0.846064 0.078708 O\n0.949055 0.346142 0.421206 O\n0.248509 0.411232 0.315758 O\n0.376588 0.314037 -0.042530 O\n0.723804 0.090850 0.631833 O\n0.752978 0.911187 0.184543 O\n0.155009 0.282160 0.068171 O\n0.351969 0.736859 0.859019 O\n0.649465 0.236972 0.640962 O\n0.846474 0.782046 0.431280 O\n0.137950 0.702924 0.659384 O\n0.863517 0.203026 0.840258 O\n0.624894 0.814009 0.542303 O\n0.787773 0.603634 0.766927 O\n0.277671 0.590745 0.867768 O\n0.727738 0.400949 0.021619 O\n",
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{
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"created_at": "2022-09-04T14:36:22.038856Z",
"updated_at": "2022-09-04T14:36:22.038871Z",
"structure_string": "P4 H12 O16\n1.0\n5.678820 0.000000 -0.490185\n0.000000 4.762627 0.000000\n0.060530 0.000000 11.331071\nP H O\n4 12 16\ndirect\n0.207660 0.185123 0.637485 P\n0.792340 0.685123 0.862514 P\n0.792340 0.814878 0.362514 P\n0.207660 0.314878 0.137485 P\n0.525111 0.147656 0.324185 H\n0.525111 0.352344 0.824185 H\n0.474889 0.852345 0.675815 H\n0.856531 0.486805 0.172604 H\n0.143469 0.986806 0.327395 H\n0.474889 0.647657 0.175815 H\n0.856531 0.013195 0.672604 H\n0.275510 0.933712 0.039372 H\n0.724490 0.433712 0.460627 H\n0.724490 0.066289 0.960627 H\n0.275510 0.566289 0.539372 H\n0.143469 0.513195 0.827395 H\n0.680826 0.386694 0.875299 O\n0.319174 0.886694 0.624701 O\n0.289106 0.182460 0.255382 O\n0.710894 0.682460 0.244618 O\n0.710894 0.817541 0.744618 O\n0.289106 0.317541 0.755382 O\n0.935599 0.347150 0.119300 O\n0.935599 0.152851 0.619300 O\n0.064401 0.652851 0.880700 O\n0.278085 0.140670 0.028304 O\n0.721915 0.640670 0.471695 O\n0.721915 0.859331 0.971695 O\n0.278085 0.359331 0.528304 O\n0.680826 0.113307 0.375299 O\n0.064401 0.847150 0.380700 O\n0.319174 0.613307 0.124701 O\n",
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{
"id": "jvasp-97654",
"created_at": "2022-09-04T14:35:42.812423Z",
"updated_at": "2022-09-04T14:35:42.812442Z",
"structure_string": "Nb8 Ni16 O36\n1.0\n5.091788 0.000000 0.000000\n-0.000000 8.733878 0.000000\n0.000000 0.000000 14.425320\nNb Ni O\n8 16 36\ndirect\n0.005016 0.031701 0.355608 Nb\n0.505016 0.468299 0.355608 Nb\n0.494984 0.468299 0.855608 Nb\n0.994984 0.031701 0.855608 Nb\n0.005016 0.968299 0.144392 Nb\n0.505016 0.531701 0.144392 Nb\n0.994984 0.968299 0.644392 Nb\n0.494984 0.531701 0.644392 Nb\n0.496109 0.164377 0.501394 Ni\n-0.004188 0.338028 0.685660 Ni\n0.495812 0.161972 0.685660 Ni\n0.496109 0.835623 0.998606 Ni\n0.003892 0.664377 0.498606 Ni\n0.504188 0.161972 0.185660 Ni\n0.504188 0.838029 0.314340 Ni\n0.503892 0.835623 0.498606 Ni\n0.996109 0.335623 0.501394 Ni\n-0.004188 0.661972 0.814340 Ni\n0.003892 0.335623 0.001394 Ni\n0.495812 0.838029 0.814340 Ni\n0.996109 0.664377 0.998606 Ni\n0.004188 0.338028 0.185660 Ni\n0.503892 0.164377 0.001394 Ni\n0.004188 0.661972 0.314340 Ni\n0.710674 0.000000 0.250000 O\n0.654530 0.652023 0.251001 O\n0.654530 0.347977 0.248999 O\n0.845470 0.152023 0.748999 O\n0.659723 0.995550 0.916182 O\n0.210674 0.500000 0.250000 O\n0.340278 0.004450 0.083818 O\n0.325079 0.326076 0.428799 O\n0.840278 0.504450 0.416182 O\n0.789327 0.500000 0.750000 O\n0.825079 0.173924 0.428799 O\n0.159722 0.504450 0.916182 O\n0.345470 0.652023 0.751001 O\n0.674921 0.326076 0.928799 O\n0.174921 0.173924 0.928799 O\n0.333986 0.336350 0.095212 O\n0.340278 0.995550 0.416182 O\n0.325079 0.673924 0.071201 O\n0.345470 0.347977 0.748999 O\n0.845470 0.847977 0.751001 O\n0.666014 0.336350 0.595212 O\n0.833986 0.836350 0.404788 O\n0.166014 0.163650 0.595212 O\n0.289327 0.000000 0.750000 O\n0.154530 0.152023 0.248999 O\n0.174921 0.826076 0.571201 O\n0.659723 0.004450 0.583818 O\n0.674921 0.673924 0.571201 O\n0.825079 0.826076 0.071201 O\n0.166014 0.836350 0.904788 O\n0.333986 0.663651 0.404788 O\n0.840278 0.495550 0.083818 O\n0.154530 0.847977 0.251001 O\n0.159722 0.495550 0.583818 O\n0.833986 0.163650 0.095212 O\n0.666014 0.663651 0.904788 O\n",
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"structure_string": "Rb4 V4 P4 O20\n1.0\n7.586146 0.000000 0.000000\n0.000000 7.840840 0.000000\n0.000000 0.000000 8.403173\nRb V P O\n4 4 4 20\ndirect\n0.370984 0.708487 0.480978 Rb\n0.129016 0.208487 0.519022 Rb\n0.870985 0.291513 0.019022 Rb\n0.629016 0.791513 0.980978 Rb\n0.137002 0.792129 0.872255 V\n0.637002 0.207871 0.627745 V\n0.862999 0.707871 0.372255 V\n0.362999 0.292129 0.127745 V\n0.624976 0.068045 0.343636 P\n0.375024 0.431955 0.843636 P\n0.875025 0.568045 0.656364 P\n0.124976 0.931955 0.156364 P\n0.821208 0.570126 0.233181 O\n0.678793 0.070126 0.766819 O\n0.321208 0.429874 0.266819 O\n0.062599 0.856231 0.316744 O\n0.312798 0.614755 0.811547 O\n0.187202 0.114755 0.188452 O\n0.521116 0.420893 0.974257 O\n0.271778 0.821172 0.075468 O\n0.021115 0.579107 0.525743 O\n0.478885 0.079107 0.474257 O\n0.687202 0.885245 0.311548 O\n0.437402 0.356231 0.683256 O\n0.937402 0.643769 0.816743 O\n0.562599 0.143769 0.183256 O\n0.728223 0.678828 0.575468 O\n0.178793 0.929874 0.733181 O\n0.228223 0.321172 0.924531 O\n0.771778 0.178828 0.424532 O\n0.978885 0.920893 0.025743 O\n0.812798 0.385245 0.688452 O\n",
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"structure_string": "Pb8 O12\n1.0\n5.763583 -0.798734 0.000462\n-0.969994 6.708040 -0.000085\n-0.000498 -0.000195 8.226025\nPb O\n8 12\ndirect\n-0.000001 0.000011 0.250000 Pb\n0.537649 0.140789 0.500007 Pb\n0.000007 0.500003 0.749992 Pb\n0.462356 0.859194 0.000011 Pb\n0.462345 0.359198 -0.000020 Pb\n-0.000017 -0.000007 0.750009 Pb\n-0.000002 0.500005 0.250002 Pb\n0.537641 0.640806 0.499987 Pb\n0.256463 0.811950 0.288940 O\n0.256461 0.311949 0.288954 O\n0.743540 0.688048 0.788952 O\n0.256457 0.311925 0.711055 O\n0.743547 0.688065 0.211059 O\n0.256454 0.811941 0.711050 O\n-0.155145 0.961677 0.500003 O\n0.743534 0.188055 0.788945 O\n0.155157 0.538332 -0.000003 O\n0.844859 0.461671 0.499999 O\n0.743542 0.188055 0.211053 O\n0.155150 0.038331 0.000001 O\n",
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{
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"structure_string": "Li2 B26 C4\n1.0\n5.229134 0.000012 2.198589\n1.859493 6.454275 2.895220\n0.001515 0.002896 7.314267\nLi B C\n2 26 4\ndirect\n0.748807 0.945549 0.556392 Li\n0.248823 0.058847 0.443145 Li\n0.089109 0.912054 0.228689 B\n0.247960 0.388034 0.113860 B\n0.571723 0.605369 0.249050 B\n0.322747 0.879067 0.979308 B\n0.071723 0.751477 0.102939 B\n0.227950 0.092277 0.770789 B\n0.727950 0.273218 0.589847 B\n0.924234 0.252856 0.896536 B\n0.165145 0.847322 0.820264 B\n0.768013 0.912054 0.228711 B\n0.747962 0.616291 0.885606 B\n0.316745 0.481731 0.376639 B\n0.830826 0.157006 0.179215 B\n0.906875 0.092281 0.770766 B\n0.589105 0.731124 0.409624 B\n0.424231 0.398967 0.750424 B\n0.330822 0.681645 0.654576 B\n0.406872 0.273197 0.589850 B\n0.673215 0.125261 0.020171 B\n0.679218 0.522599 0.622830 B\n0.268014 0.731147 0.409621 B\n0.816746 0.879069 0.979300 B\n0.173215 0.522610 0.622823 B\n0.179220 0.125258 0.020165 B\n0.822746 0.481738 0.376640 B\n0.665145 0.322689 0.344898 B\n0.378571 0.251175 0.989544 C\n0.617397 0.753147 0.009926 C\n0.117396 0.512352 0.250722 C\n0.878564 0.491981 0.748742 C\n",
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