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{
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{
"id": "mp-1410431",
"created_at": "2022-09-04T14:43:34.405036Z",
"structure_string": "Zn2 Ni2 F10\n1.0\n4.888448 -0.023900 -1.716349\n-2.104411 4.679498 -0.719041\n0.125820 0.012484 7.431948\nZn Ni F\n2 2 10\ndirect\n0.289056 0.540645 0.749998 Zn\n0.711429 0.463113 0.250826 Zn\n0.001425 0.004313 0.000729 Ni\n0.499775 0.000978 0.500342 Ni\n0.364229 0.119400 0.251894 F\n0.635669 0.884218 0.749366 F\n0.586673 0.736635 0.370215 F\n0.863057 0.224801 0.123232 F\n0.756439 0.691109 0.045198 F\n0.140718 0.712525 0.459311 F\n0.249702 0.318407 0.958470 F\n0.859163 0.286534 0.542242 F\n0.134615 0.781962 0.872794 F\n0.412608 0.264914 0.630539 F\n",
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{
"id": "mp-1188417",
"created_at": "2022-09-04T14:43:34.176148Z",
"structure_string": "Ho10 In6\n1.0\n4.509200 -7.810163 0.000000\n4.509200 7.810163 0.000000\n0.000000 0.000000 6.668959\nHo In\n10 6\ndirect\n0.666667 0.333333 0.000000 Ho\n0.333333 0.666667 0.000000 Ho\n0.333333 0.666667 0.500000 Ho\n0.666667 0.333333 0.500000 Ho\n0.749834 0.749834 0.750000 Ho\n0.250166 0.000000 0.750000 Ho\n0.000000 0.250166 0.750000 Ho\n0.250166 0.250166 0.250000 Ho\n0.749834 0.000000 0.250000 Ho\n0.000000 0.749834 0.250000 Ho\n0.393689 0.393689 0.750000 In\n0.606311 0.000000 0.750000 In\n0.000000 0.606311 0.750000 In\n0.606311 0.606311 0.250000 In\n0.393689 0.000000 0.250000 In\n0.000000 0.393689 0.250000 In\n",
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{
"id": "mp-558305",
"created_at": "2022-09-04T14:43:34.178512Z",
"structure_string": "Rb4 Ag8 Pd6 N24 O48\n1.0\n24.512529 0.000000 0.000000\n0.000000 7.326644 0.000000\n0.000000 6.134120 7.716965\nRb Ag Pd N O\n4 8 6 24 48\ndirect\n0.133415 0.313098 0.587171 Rb\n0.633415 0.686902 0.912829 Rb\n0.866585 0.686902 0.412829 Rb\n0.366585 0.313098 0.087171 Rb\n0.317076 0.574791 0.317795 Ag\n0.527259 0.231761 0.393501 Ag\n0.182924 0.574791 0.817795 Ag\n0.817076 0.425209 0.182205 Ag\n0.027259 0.768239 0.106499 Ag\n0.472741 0.768239 0.606499 Ag\n0.972741 0.231761 0.893501 Ag\n0.682924 0.425209 0.682205 Ag\n0.675613 0.829262 0.280803 Pd\n0.824387 0.829262 0.780803 Pd\n0.500000 0.000000 0.000000 Pd\n0.324387 0.170738 0.719197 Pd\n0.175613 0.170738 0.219197 Pd\n0.000000 0.000000 0.500000 Pd\n0.376159 0.016485 0.649526 N\n0.267696 0.915928 0.796719 N\n0.227916 0.329910 0.282163 N\n0.432822 0.783064 0.101985 N\n0.623841 0.983515 0.350474 N\n0.067178 0.783064 0.601985 N\n0.503393 0.015840 0.781878 N\n0.496607 0.984160 0.218122 N\n0.727916 0.670090 0.217837 N\n0.732304 0.084072 0.203281 N\n0.383113 0.422421 0.647044 N\n0.567178 0.216936 0.898015 N\n0.116887 0.422421 0.147044 N\n0.876159 0.983515 0.850474 N\n0.767696 0.084072 0.703281 N\n0.932822 0.216936 0.398015 N\n0.996607 0.015840 0.281878 N\n0.883113 0.577579 0.852956 N\n0.272084 0.329910 0.782163 N\n0.616887 0.577579 0.352956 N\n0.003393 0.984160 0.718122 N\n0.123841 0.016485 0.149526 N\n0.232304 0.915928 0.296719 N\n0.772084 0.670090 0.717837 N\n0.612888 0.881165 0.505478 O\n0.387630 0.863496 0.103085 O\n0.887630 0.136504 0.396915 O\n0.981513 0.838862 0.299077 O\n0.209802 0.472766 0.299516 O\n0.790198 0.527234 0.700484 O\n0.727592 0.044600 0.797259 O\n0.437865 0.574816 0.166578 O\n0.113600 0.597058 0.990210 O\n0.774394 0.277754 0.560668 O\n0.937865 0.425184 0.333422 O\n0.992315 0.798831 0.864824 O\n0.221510 0.291932 0.796162 O\n0.272408 0.955400 0.202741 O\n0.112888 0.118835 0.994522 O\n0.227592 0.955400 0.702741 O\n0.007685 0.201169 0.135176 O\n0.481513 0.161138 0.200923 O\n0.778490 0.708068 0.203838 O\n0.772408 0.044600 0.297259 O\n0.018487 0.161138 0.700923 O\n0.562135 0.425184 0.833422 O\n0.290198 0.472766 0.799516 O\n0.112370 0.863496 0.603085 O\n0.721510 0.708068 0.703838 O\n0.709802 0.527234 0.200484 O\n0.897871 0.175756 0.733959 O\n0.102129 0.824244 0.266041 O\n0.086735 0.408672 0.255293 O\n0.507685 0.798831 0.364824 O\n0.913265 0.591328 0.744707 O\n0.886400 0.402942 0.009790 O\n0.492315 0.201169 0.635176 O\n0.613600 0.402942 0.509790 O\n0.225606 0.722246 0.439332 O\n0.602129 0.175756 0.233959 O\n0.725606 0.277754 0.060668 O\n0.274394 0.722246 0.939332 O\n0.386400 0.597058 0.490210 O\n0.278490 0.291932 0.296162 O\n0.062135 0.574816 0.666578 O\n0.612370 0.136504 0.896915 O\n0.413265 0.408672 0.755293 O\n0.887112 0.881165 0.005478 O\n0.586735 0.591328 0.244707 O\n0.387112 0.118835 0.494522 O\n0.518487 0.838862 0.799077 O\n0.397871 0.824244 0.766041 O\n",
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"elements": [
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],
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"density": 3.5314948179449313,
"density_atomic": 0.06493857714389371,
"volume": 1385.9250380644173,
"volume_molar": 9.273595180035866,
"formula_full": "Rb4 Ag8 Pd6 N24 O48",
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{
"id": "mp-683922",
"created_at": "2022-09-04T14:43:34.181370Z",
"structure_string": "Ce12 Ge18 B4 O60\n1.0\n10.917464 0.000000 0.000000\n0.000000 8.870282 0.000000\n0.000000 7.757395 10.816523\nCe Ge B O\n12 18 4 60\ndirect\n0.678219 0.262964 0.231692 Ce\n0.668300 0.986335 0.057276 Ce\n0.178219 0.737036 0.268308 Ce\n0.667586 0.708130 0.444958 Ce\n0.821781 0.262964 0.731692 Ce\n0.332414 0.291870 0.555042 Ce\n0.331700 0.013665 0.942724 Ce\n0.168300 0.013665 0.442724 Ce\n0.167586 0.291870 0.055042 Ce\n0.831700 0.986335 0.557276 Ce\n0.832414 0.708130 0.944958 Ce\n0.321781 0.737036 0.768308 Ce\n0.538384 0.376808 0.968879 Ge\n0.326864 0.373175 0.262663 Ge\n0.082948 0.001418 0.749154 Ge\n0.514531 0.614221 0.261035 Ge\n0.461616 0.623192 0.031121 Ge\n0.985469 0.614221 0.761035 Ge\n0.038384 0.623192 0.531121 Ge\n0.673136 0.626825 0.737337 Ge\n0.917052 0.998582 0.250846 Ge\n0.500000 0.000000 0.500000 Ge\n0.582948 0.998582 0.750846 Ge\n0.014531 0.385779 0.238965 Ge\n0.826864 0.626825 0.237337 Ge\n0.485469 0.385779 0.738965 Ge\n0.417052 0.001418 0.249154 Ge\n0.961616 0.376808 0.468879 Ge\n0.000000 0.000000 0.000000 Ge\n0.173136 0.373175 0.762663 Ge\n0.336473 0.693854 0.525386 B\n0.663527 0.306146 0.474614 B\n0.836473 0.306146 0.974614 B\n0.163527 0.693854 0.025386 B\n0.514543 0.565830 0.790825 O\n0.429554 0.550293 0.569784 O\n0.188757 0.007655 0.636294 O\n0.610658 0.533658 0.016093 O\n0.136455 0.821560 0.061311 O\n0.329945 0.366104 0.807169 O\n0.048696 0.832429 0.370655 O\n0.685815 0.192823 0.610876 O\n0.017662 0.787420 0.581136 O\n0.814185 0.192823 0.110876 O\n0.304216 0.189635 0.233877 O\n0.145675 0.543489 0.813788 O\n0.029061 0.000016 0.139488 O\n0.517662 0.212580 0.918864 O\n0.645675 0.456511 0.686212 O\n0.570446 0.449707 0.430216 O\n0.688757 0.992345 0.863706 O\n0.470939 0.000016 0.639488 O\n0.466363 0.185353 0.732299 O\n0.368221 0.180862 0.429170 O\n0.951304 0.167571 0.629345 O\n0.889342 0.533658 0.516093 O\n0.131779 0.180862 0.929170 O\n0.482338 0.787420 0.081136 O\n0.195784 0.189635 0.733877 O\n0.970939 0.999984 0.860512 O\n0.811243 0.992345 0.363706 O\n0.854325 0.456511 0.186212 O\n0.711674 0.397359 0.913153 O\n0.451304 0.832429 0.870655 O\n0.170055 0.366104 0.307169 O\n0.929554 0.449707 0.930216 O\n0.311243 0.007655 0.136294 O\n0.863545 0.178440 0.938689 O\n0.389342 0.466342 0.983907 O\n0.788326 0.397359 0.413153 O\n0.670055 0.633896 0.192831 O\n0.185815 0.807177 0.889124 O\n0.829945 0.633896 0.692831 O\n0.868221 0.819138 0.070830 O\n0.982338 0.212580 0.418864 O\n0.070446 0.550293 0.069784 O\n0.548696 0.167571 0.129345 O\n0.110658 0.466342 0.483907 O\n0.804216 0.810365 0.266123 O\n0.966363 0.814647 0.767701 O\n0.211674 0.602641 0.586847 O\n0.985457 0.565830 0.290825 O\n0.014543 0.434170 0.709175 O\n0.288326 0.602641 0.086847 O\n0.636455 0.178440 0.438689 O\n0.533637 0.814647 0.267701 O\n0.363545 0.821560 0.561311 O\n0.485457 0.434170 0.209175 O\n0.631779 0.819138 0.570830 O\n0.695784 0.810365 0.766123 O\n0.354325 0.543489 0.313788 O\n0.033637 0.185353 0.232299 O\n0.314185 0.807177 0.389124 O\n0.529061 0.999984 0.360512 O\n",
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{
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"structure_string": "Rb4 Ag8 S6\n1.0\n2.174740 9.124832 0.000000\n-2.174740 9.124832 0.000000\n0.000000 3.809412 11.380841\nRb Ag S\n4 8 6\ndirect\n0.810884 0.810884 0.843249 Rb\n0.189116 0.189116 0.156751 Rb\n0.667914 0.667914 0.659232 Rb\n0.332086 0.332086 0.340768 Rb\n0.589236 0.589236 0.991468 Ag\n0.410764 0.410764 0.008532 Ag\n0.989160 0.989160 0.375143 Ag\n0.010840 0.010840 0.624857 Ag\n0.982007 0.982007 0.132274 Ag\n0.017993 0.017993 0.867726 Ag\n0.588339 0.588339 0.412444 Ag\n0.411661 0.411661 0.587556 Ag\n0.533854 0.533854 0.225239 S\n0.466146 0.466146 0.774761 S\n0.861863 0.861863 0.540088 S\n0.138137 0.138137 0.459912 S\n0.848259 0.848259 0.107053 S\n0.151741 0.151741 0.892947 S\n",
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{
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"structure_string": "Cu2 S2 N2 O6\n1.0\n-2.837141 -4.914072 0.000000\n-5.674282 0.000000 0.000000\n-2.837141 -1.638024 -7.391908\nCu S N O\n2 2 2 6\ndirect\n0.787438 0.787438 0.637685 Cu\n0.212561 0.212561 0.362316 Cu\n0.886471 0.886471 0.340588 S\n0.113529 0.113529 0.659412 S\n0.637968 0.637968 0.086095 N\n0.362032 0.362032 0.913905 N\n0.378392 0.947038 0.727533 O\n0.947038 0.378392 0.727533 O\n0.947038 0.947038 0.727533 O\n0.621608 0.052962 0.272467 O\n0.052962 0.621608 0.272467 O\n0.052962 0.052962 0.272467 O\n",
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{
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"structure_string": "Co4 Ag4 O12\n1.0\n2.616624 -4.398307 0.359361\n2.787063 1.135736 5.213427\n-4.705129 -3.043187 5.011198\nCo Ag O\n4 4 12\ndirect\n0.496981 0.819388 0.664333 Co\n0.503103 0.180530 0.335656 Co\n0.996819 0.319527 0.164491 Co\n0.003246 0.680524 0.835525 Co\n0.004481 0.720189 0.341743 Ag\n0.504125 0.220017 0.841804 Ag\n0.995323 0.279836 0.658166 Ag\n0.495849 0.779889 0.158220 Ag\n0.839505 0.662219 0.619803 O\n0.339364 0.162334 0.119938 O\n0.598775 0.120157 0.576305 O\n0.099009 0.620252 0.076269 O\n0.168423 0.940046 0.757409 O\n0.668580 0.440254 0.258013 O\n0.831503 0.059785 0.242522 O\n0.331589 0.559712 0.742112 O\n0.401099 0.879840 0.423715 O\n0.901120 0.379806 0.923872 O\n0.160503 0.338015 0.380049 O\n0.660603 0.837681 0.880055 O\n",
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{
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"structure_string": "Pr1 Mn1 Ni4\n1.0\n2.522324 -4.368794 0.000000\n2.522324 4.368794 0.000000\n0.000000 0.000000 3.977867\nPr Mn Ni\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Pr\n0.333333 0.666667 0.000000 Mn\n0.666667 0.333333 0.000000 Ni\n0.501606 0.003211 0.500000 Ni\n0.996789 0.498394 0.500000 Ni\n0.501606 0.498394 0.500000 Ni\n",
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