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{
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"results": [
{
"id": "mp-1233274",
"created_at": "2022-09-04T14:39:16.618064Z",
"structure_string": "Rb2 Ba8 Ca1 Sb6 O2\n1.0\n8.628227 -0.362976 -3.897241\n-2.303270 8.100155 -3.847982\n0.005252 0.116575 10.481182\nRb Ba Ca Sb O\n2 8 1 6 2\ndirect\n0.004023 0.007531 0.000075 Rb\n0.412672 0.412425 0.813199 Rb\n0.507862 0.722325 0.693136 Ba\n0.197720 0.987446 0.701439 Ba\n0.827233 0.038844 0.325834 Ba\n0.992663 0.545517 0.741157 Ba\n0.512950 0.300494 0.326332 Ba\n0.759015 0.206102 0.739476 Ba\n0.025877 0.487532 0.292951 Ba\n0.272541 0.823989 0.292633 Ba\n0.589407 0.593189 0.171396 Ca\n0.825264 0.641277 0.022549 Sb\n0.618643 0.144945 0.012831 Sb\n0.208297 0.396029 0.024005 Sb\n0.406036 0.878861 0.012746 Sb\n0.219716 0.227055 0.428940 Sb\n0.776251 0.773196 0.537503 Sb\n0.771596 0.271484 0.532356 O\n0.257949 0.763188 0.506442 O\n",
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{
"id": "mp-865494",
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"structure_string": "V2 Cr1 Ru1\n1.0\n0.000000 2.962938 2.962938\n2.962938 0.000000 2.962938\n2.962938 2.962938 0.000000\nV Cr Ru\n2 1 1\ndirect\n0.750000 0.750000 0.750000 V\n0.250000 0.250000 0.250000 V\n0.500000 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Ru\n",
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},
{
"id": "mp-600191",
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"structure_string": "B40 H120 C24 N8\n1.0\n16.968143 0.000000 0.000000\n0.000000 8.567710 0.000000\n0.000000 2.270352 12.012097\nB H C N\n40 120 24 8\ndirect\n0.168675 0.153960 0.642100 B\n0.807864 0.867725 0.209328 B\n0.435977 0.128823 0.176220 B\n0.365712 0.000832 0.239400 B\n0.865712 0.999168 0.260600 B\n0.193680 0.325213 0.701833 B\n0.863506 0.707006 0.169771 B\n0.806320 0.674787 0.298167 B\n0.935977 0.871177 0.323780 B\n0.363506 0.292994 0.330229 B\n0.954817 0.709511 0.250527 B\n0.613429 0.562097 0.780269 B\n0.603038 0.677067 0.879573 B\n0.331325 0.153960 0.142100 B\n0.454817 0.290489 0.249473 B\n0.587630 0.891929 0.675165 B\n0.668675 0.846040 0.857900 B\n0.634288 0.999168 0.760600 B\n0.912370 0.891929 0.175165 B\n0.064023 0.128823 0.676220 B\n0.386571 0.437903 0.219731 B\n0.396962 0.322933 0.120427 B\n0.831325 0.846040 0.357900 B\n0.896962 0.677067 0.379573 B\n0.545183 0.709511 0.750527 B\n0.693680 0.674787 0.798167 B\n0.636494 0.707006 0.669771 B\n0.886571 0.562097 0.280269 B\n0.045183 0.290489 0.749473 B\n0.306320 0.325213 0.201833 B\n0.103038 0.322933 0.620427 B\n0.412370 0.108071 0.324835 B\n0.307864 0.132275 0.290672 B\n0.192136 0.132275 0.790672 B\n0.113429 0.437903 0.719731 B\n0.692136 0.867725 0.709328 B\n0.087630 0.108071 0.824835 B\n0.136494 0.292994 0.830229 B\n0.564023 0.871177 0.823780 B\n0.134288 0.000832 0.739400 B\n0.838862 0.846210 0.855113 H\n0.727900 0.488342 0.569215 H\n0.415467 0.046848 0.588559 H\n0.002833 0.271178 0.036053 H\n0.892083 0.421220 0.284521 H\n0.875996 0.681019 0.715130 H\n0.885247 0.014498 0.769220 H\n0.077415 0.152242 0.370175 H\n0.850374 0.676752 0.079190 H\n0.114753 0.985502 0.230780 H\n0.526088 0.392451 0.636141 H\n0.926899 0.601298 0.916543 H\n0.242107 0.691100 0.338029 H\n0.350374 0.323248 0.420810 H\n0.478089 0.678249 0.729492 H\n0.915467 0.953152 0.911441 H\n0.679950 0.345245 0.437178 H\n0.757893 0.308900 0.661971 H\n0.227900 0.511658 0.930785 H\n0.412297 0.719126 0.947429 H\n0.994673 0.120675 0.220563 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H\n0.510728 0.921385 0.872818 H\n0.022032 0.330583 0.323229 H\n0.343539 0.879682 0.910290 H\n0.843539 0.120318 0.589710 H\n0.412619 0.379329 0.025314 H\n0.156461 0.879682 0.410290 H\n0.656461 0.120318 0.089710 H\n0.445996 0.041042 0.407338 H\n0.750987 0.911247 0.657686 H\n0.945996 0.958958 0.092662 H\n0.257613 0.789487 0.620967 H\n0.107917 0.578780 0.715479 H\n0.206419 0.127742 0.564272 H\n0.179950 0.654755 0.062822 H\n0.706419 0.872258 0.935728 H\n0.010728 0.078615 0.627182 H\n0.522032 0.669417 0.176771 H\n0.021911 0.678249 0.229492 H\n0.587381 0.620671 0.974686 H\n0.375996 0.318981 0.784870 H\n0.577415 0.847758 0.129825 H\n0.587703 0.280874 0.052571 H\n0.385247 0.985502 0.730780 H\n0.978089 0.321751 0.770508 H\n0.973912 0.392451 0.136141 H\n0.257893 0.691100 0.838029 H\n0.505327 0.120675 0.720563 H\n0.607917 0.421220 0.784521 H\n0.161138 0.153790 0.144887 H\n0.380187 0.831717 0.050467 H\n0.757613 0.210513 0.879033 H\n0.272100 0.511658 0.430785 H\n0.815998 0.420967 0.431770 H\n0.554004 0.958958 0.592662 H\n0.426899 0.398702 0.583457 H\n0.820050 0.345245 0.937178 H\n0.249013 0.088753 0.342314 H\n0.772100 0.488342 0.069215 H\n0.977968 0.669417 0.676771 H\n0.672282 0.464800 0.115303 H\n0.293642 0.844589 0.480948 H\n0.257105 0.387659 0.679282 H\n0.584533 0.953152 0.411441 H\n0.206358 0.844589 0.980948 H\n0.573101 0.601298 0.416543 H\n0.757105 0.612341 0.820718 H\n0.124004 0.318981 0.284870 H\n0.922585 0.847758 0.629825 H\n0.327718 0.535200 0.884697 H\n0.649626 0.676752 0.579190 H\n0.684002 0.420967 0.931770 H\n0.026088 0.607549 0.863859 H\n0.359519 0.859672 0.245582 H\n0.473912 0.607549 0.363859 H\n0.749013 0.911247 0.157686 H\n0.497167 0.271178 0.536053 H\n0.320050 0.654755 0.562822 H\n0.073101 0.398702 0.083457 H\n0.997167 0.728822 0.963947 H\n0.392083 0.578780 0.215479 H\n0.859519 0.140328 0.254418 H\n0.477968 0.330583 0.823229 H\n0.087703 0.719126 0.447429 H\n0.005327 0.879325 0.779437 H\n0.912619 0.620671 0.474686 H\n0.119813 0.831717 0.550467 H\n0.725921 0.254241 0.454335 C\n0.606142 0.912741 0.336886 C\n0.478525 0.323512 0.607167 C\n0.393858 0.087259 0.663114 C\n0.363405 0.783714 0.976884 C\n0.724355 0.402841 0.092736 C\n0.568725 0.746835 0.198149 C\n0.863405 0.216286 0.523116 C\n0.275645 0.597159 0.907264 C\n0.431275 0.253165 0.801851 C\n0.068725 0.253165 0.301851 C\n0.021475 0.323512 0.107167 C\n0.224355 0.597159 0.407264 C\n0.978525 0.676488 0.892833 C\n0.774079 0.254241 0.954335 C\n0.931275 0.746835 0.698149 C\n0.775645 0.402841 0.592736 C\n0.893858 0.912741 0.836886 C\n0.274079 0.745759 0.545665 C\n0.636595 0.216286 0.023116 C\n0.225921 0.745759 0.045665 C\n0.521475 0.676488 0.392833 C\n0.106142 0.087259 0.163114 C\n0.136595 0.783714 0.476884 C\n0.455681 0.191562 0.699827 N\n0.044319 0.191562 0.199827 N\n0.296494 0.670372 0.004756 N\n0.703506 0.329628 0.995244 N\n0.203506 0.670372 0.504756 N\n0.955681 0.808438 0.800173 N\n0.796494 0.329628 0.495244 N\n0.544319 0.808438 0.300173 N\n",
"nsites": 192,
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"elements": [
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"formula_full": "B40 H120 C24 N8",
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{
"id": "mp-974068",
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"structure_string": "Nd3 Th1\n1.0\n-2.577005 2.577005 5.186033\n2.577005 -2.577005 5.186033\n2.577005 2.577005 -5.186033\nNd Th\n3 1\ndirect\n0.750000 0.250000 0.500000 Nd\n0.250000 0.750000 0.500000 Nd\n0.500000 0.500000 0.000000 Nd\n0.000000 0.000000 0.000000 Th\n",
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{
"id": "mp-1191567",
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"structure_string": "Na4 Ti2 H8 O10\n1.0\n3.057047 0.000000 0.000000\n-0.009415 4.222333 0.000000\n-0.949735 -0.872531 21.657085\nNa Ti H O\n4 2 8 10\ndirect\n0.525447 0.017762 0.579011 Na\n0.474553 0.982238 0.420989 Na\n0.474560 0.484592 0.921028 Na\n0.525440 0.515408 0.078972 Na\n0.000000 0.000000 0.000000 Ti\n0.000000 0.500000 0.500000 Ti\n0.838139 0.496473 0.803169 H\n0.161861 0.503527 0.196831 H\n0.162173 0.964078 0.696190 H\n0.837827 0.035922 0.303810 H\n0.475948 0.188998 0.738106 H\n0.524052 0.811002 0.261894 H\n0.515359 0.694341 0.761822 H\n0.484641 0.305659 0.238178 H\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.518781 0.513465 0.559731 O\n0.481219 0.486535 0.440269 O\n0.481198 0.988456 0.940282 O\n0.518802 0.011544 0.059718 O\n0.531291 0.502515 0.787868 O\n0.468709 0.497485 0.212132 O\n0.467237 0.987418 0.711802 O\n0.532763 0.012582 0.288198 O\n",
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{
"id": "mp-1516265",
"created_at": "2022-09-04T14:39:16.666273Z",
"structure_string": "Sr1 Ca1 Cu1 Bi1 O6\n1.0\n0.000000 -4.057204 -4.057204\n4.057204 0.000000 -4.057204\n4.057204 -4.057204 -0.000000\nSr Ca Cu Bi O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Sr\n0.250000 0.250000 0.250000 Ca\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Bi\n0.739450 0.260550 0.260550 O\n0.260550 0.739450 0.739450 O\n0.739450 0.260550 0.739450 O\n0.260550 0.739450 0.260550 O\n0.739450 0.739450 0.260550 O\n0.260550 0.260550 0.739450 O\n",
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{
"id": "mp-1211956",
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"structure_string": "K8 Na16 Zn4 Sn8\n1.0\n10.044929 0.000000 0.000000\n0.000000 11.484170 0.000000\n0.000000 5.739801 10.185190\nK Na Zn Sn\n8 16 4 8\ndirect\n0.607898 0.703288 0.176685 K\n0.392102 0.296712 0.823315 K\n0.107898 0.796712 0.823315 K\n0.892102 0.203288 0.176685 K\n0.967136 0.816668 0.144867 K\n0.032864 0.183332 0.855133 K\n0.467136 0.683332 0.855133 K\n0.532864 0.316668 0.144867 K\n0.840338 0.576126 0.489816 Na\n0.159662 0.423874 0.510184 Na\n0.340338 0.923874 0.510184 Na\n0.659662 0.076126 0.489816 Na\n0.822489 0.572840 0.007186 Na\n0.177511 0.427160 0.992814 Na\n0.322489 0.927160 0.992814 Na\n0.677511 0.072840 0.007186 Na\n0.524580 0.622044 0.575952 Na\n0.475420 0.377956 0.424048 Na\n0.024580 0.877956 0.424048 Na\n0.975420 0.122044 0.575952 Na\n0.777803 0.761502 0.668023 Na\n0.222197 0.238498 0.331977 Na\n0.277803 0.738498 0.331977 Na\n0.722197 0.261502 0.668023 Na\n0.464678 0.987953 0.243465 Zn\n0.535322 0.012047 0.756535 Zn\n0.964678 0.512047 0.756535 Zn\n0.035322 0.487953 0.243465 Zn\n0.275619 0.576932 0.161500 Sn\n0.724381 0.423068 0.838500 Sn\n0.775619 0.923068 0.838500 Sn\n0.224381 0.076932 0.161500 Sn\n0.691682 0.885333 0.352129 Sn\n0.308318 0.114667 0.647871 Sn\n0.191682 0.614667 0.647871 Sn\n0.808318 0.385333 0.352129 Sn\n",
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"formula_full": "K8 Na16 Zn4 Sn8",
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