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{
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{
"id": "mp-730273",
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"structure_string": "Zn1 Cu1 C8 N5\n1.0\n0.000000 5.854747 5.854747\n5.854747 0.000000 5.854747\n5.854747 5.854747 0.000000\nZn Cu C N\n1 1 8 5\ndirect\n0.750000 0.750000 0.750000 Zn\n0.000000 0.000000 0.000000 Cu\n0.427652 0.427652 0.427652 C\n0.427652 0.717043 0.427652 C\n0.717043 0.427652 0.427652 C\n0.427652 0.427652 0.717043 C\n0.904469 0.904469 0.904469 C\n0.904469 0.286593 0.904469 C\n0.286593 0.904469 0.904469 C\n0.904469 0.904469 0.286593 C\n0.500000 0.500000 0.500000 N\n0.846779 0.846779 0.846779 N\n0.846779 0.459663 0.846779 N\n0.459663 0.846779 0.846779 N\n0.846779 0.846779 0.459663 N\n",
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{
"id": "mp-1199091",
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"structure_string": "Li12 B20 H8 O40\n1.0\n6.940908 0.000000 0.000000\n0.000000 6.940908 0.000000\n0.000000 0.000000 14.695267\nLi B H O\n12 20 8 40\ndirect\n0.364831 0.351807 0.092939 Li\n0.635169 0.648193 0.592939 Li\n0.851807 0.135169 0.342939 Li\n0.148193 0.864831 0.842939 Li\n0.648193 0.635169 0.407061 Li\n0.351807 0.364831 0.907061 Li\n0.135169 0.851807 0.657061 Li\n0.864831 0.148193 0.157061 Li\n0.305654 0.694346 0.250000 Li\n0.694346 0.305654 0.750000 Li\n0.194346 0.194346 0.500000 Li\n0.805654 0.805654 0.000000 Li\n0.256838 0.997358 0.142251 B\n0.743162 0.002642 0.642251 B\n0.497358 0.243162 0.392251 B\n0.502642 0.756838 0.892251 B\n0.002642 0.743162 0.357749 B\n0.997358 0.256838 0.857749 B\n0.243162 0.497358 0.607749 B\n0.756838 0.502642 0.107749 B\n0.257046 0.238956 0.272160 B\n0.742954 0.761044 0.772160 B\n0.738956 0.242954 0.522160 B\n0.261044 0.757046 0.022160 B\n0.761044 0.742954 0.227840 B\n0.238956 0.257046 0.727840 B\n0.242954 0.738956 0.477840 B\n0.757046 0.261044 0.977840 B\n0.563708 0.436292 0.250000 B\n0.436292 0.563708 0.750000 B\n0.936292 0.936292 0.500000 B\n0.063708 0.063708 0.000000 B\n0.014947 0.401583 0.266104 H\n0.985053 0.598417 0.766104 H\n0.901583 0.485053 0.516104 H\n0.098417 0.514947 0.016104 H\n0.598417 0.985053 0.233896 H\n0.401583 0.014947 0.733896 H\n0.485053 0.901583 0.483896 H\n0.514947 0.098417 0.983896 H\n0.280925 0.807498 0.119878 O\n0.719075 0.192502 0.619878 O\n0.307498 0.219075 0.369878 O\n0.692502 0.780925 0.869878 O\n0.192502 0.719075 0.380122 O\n0.807498 0.280925 0.880122 O\n0.219075 0.307498 0.630122 O\n0.780925 0.692502 0.130122 O\n0.357677 0.404549 0.231013 O\n0.642323 0.595451 0.731013 O\n0.904549 0.142323 0.481013 O\n0.095451 0.857677 0.981013 O\n0.595451 0.642323 0.268987 O\n0.404549 0.357677 0.768987 O\n0.142323 0.904549 0.518987 O\n0.857677 0.095451 0.018987 O\n0.676192 0.371320 0.168026 O\n0.323808 0.628680 0.668026 O\n0.871320 0.823808 0.418026 O\n0.128680 0.176192 0.918026 O\n0.628680 0.323808 0.331974 O\n0.371320 0.676192 0.831974 O\n0.823808 0.871320 0.581974 O\n0.176192 0.128680 0.081974 O\n0.315538 0.053312 0.227553 O\n0.684462 0.946688 0.727553 O\n0.553312 0.184462 0.477553 O\n0.446688 0.815538 0.977553 O\n0.946688 0.684462 0.272447 O\n0.053312 0.315538 0.772447 O\n0.184462 0.553312 0.522447 O\n0.815538 0.446688 0.022447 O\n0.045815 0.263014 0.262443 O\n0.954185 0.736986 0.762443 O\n0.763014 0.454185 0.512443 O\n0.236986 0.545815 0.012443 O\n0.736986 0.954185 0.237557 O\n0.263014 0.045815 0.737557 O\n0.454185 0.763014 0.487557 O\n0.545815 0.236986 0.987557 O\n",
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{
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"created_at": "2022-09-04T14:44:10.688888Z",
"structure_string": "Sn4 S8 O16\n1.0\n7.742389 0.000000 0.000000\n0.000000 7.419649 0.000000\n0.000000 5.622584 9.723783\nSn S O\n4 8 16\ndirect\n0.741849 0.595196 0.583909 Sn\n0.241849 0.404804 0.916091 Sn\n0.258151 0.404804 0.416091 Sn\n0.758151 0.595196 0.083909 Sn\n0.517274 0.121683 0.712734 S\n0.017274 0.878317 0.787266 S\n0.482726 0.878317 0.287266 S\n0.982726 0.121683 0.212734 S\n0.680631 0.191417 0.509204 S\n0.180631 0.808583 0.990796 S\n0.319369 0.808583 0.490796 S\n0.819369 0.191417 0.009204 S\n0.342261 0.192289 0.640634 O\n0.842261 0.807711 0.859366 O\n0.657739 0.807711 0.359366 O\n0.157739 0.192289 0.140634 O\n0.527676 0.271232 0.410009 O\n0.027676 0.728768 0.089991 O\n0.472324 0.728768 0.589991 O\n0.972324 0.271232 0.910009 O\n0.601104 0.293825 0.730041 O\n0.101104 0.706175 0.769959 O\n0.398896 0.706175 0.269959 O\n0.898896 0.293825 0.230041 O\n0.713663 0.371406 0.001036 O\n0.213663 0.628594 0.498964 O\n0.286337 0.628594 0.998964 O\n0.786337 0.371406 0.501036 O\n",
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{
"id": "mp-707364",
"created_at": "2022-09-04T14:44:10.692132Z",
"structure_string": "Ag8 H24 C8 N24 O32\n1.0\n16.847434 0.000000 0.000000\n0.000000 6.718299 0.000000\n0.000000 3.659393 10.081022\nAg H C N O\n8 24 8 24 32\ndirect\n0.814707 0.073726 0.772675 Ag\n0.685293 0.073726 0.272675 Ag\n0.185293 0.926274 0.227325 Ag\n0.314707 0.926274 0.727325 Ag\n0.972808 0.605517 0.325877 Ag\n0.527192 0.605517 0.825877 Ag\n0.027192 0.394483 0.674123 Ag\n0.472808 0.394483 0.174123 Ag\n0.088141 0.631340 0.117860 H\n0.411859 0.631340 0.617860 H\n0.911859 0.368660 0.882140 H\n0.588141 0.368660 0.382140 H\n0.187813 0.576097 0.106225 H\n0.312187 0.576097 0.606225 H\n0.812187 0.423903 0.893775 H\n0.687813 0.423903 0.393775 H\n0.191661 0.176362 0.421313 H\n0.308339 0.176362 0.921313 H\n0.808339 0.823638 0.578687 H\n0.691661 0.823638 0.078687 H\n0.247695 0.320662 0.285071 H\n0.252305 0.320662 0.785071 H\n0.752305 0.679338 0.714929 H\n0.747695 0.679338 0.214929 H\n0.954666 0.180304 0.153547 H\n0.545334 0.180304 0.653547 H\n0.045334 0.819696 0.846453 H\n0.454666 0.819696 0.346453 H\n0.854871 0.276456 0.143168 H\n0.645129 0.276456 0.643168 H\n0.145129 0.723544 0.856832 H\n0.354871 0.723544 0.356832 H\n0.129594 0.400133 0.278519 C\n0.370406 0.400133 0.778519 C\n0.870406 0.599867 0.721481 C\n0.629594 0.599867 0.221481 C\n0.881072 0.018200 0.304818 C\n0.618928 0.018200 0.804818 C\n0.118928 0.981800 0.695182 C\n0.381072 0.981800 0.195182 C\n0.140011 0.573502 0.166388 N\n0.359989 0.573502 0.666388 N\n0.859989 0.426498 0.833612 N\n0.640011 0.426498 0.333612 N\n0.192902 0.268330 0.323272 N\n0.307098 0.268330 0.823272 N\n0.807098 0.731670 0.676728 N\n0.692902 0.731670 0.176728 N\n0.940606 0.876623 0.361341 N\n0.559394 0.876623 0.861341 N\n0.059394 0.123377 0.638659 N\n0.440606 0.123377 0.138659 N\n0.898917 0.177643 0.193190 N\n0.601083 0.177643 0.693190 N\n0.101083 0.822357 0.806810 N\n0.398917 0.822357 0.306810 N\n0.920123 0.810570 0.002024 N\n0.579877 0.810570 0.502024 N\n0.079877 0.189430 0.997976 N\n0.420123 0.189430 0.497976 N\n0.825944 0.368064 0.482471 N\n0.674056 0.368064 0.982471 N\n0.174056 0.631936 0.517529 N\n0.325944 0.631936 0.017529 N\n0.854157 0.840014 0.045817 O\n0.645843 0.840014 0.545817 O\n0.145843 0.159986 0.954183 O\n0.354157 0.159986 0.454183 O\n0.934513 0.885354 0.877325 O\n0.565487 0.885354 0.377325 O\n0.065487 0.114646 0.122675 O\n0.434513 0.114646 0.622675 O\n0.975132 0.705636 0.079299 O\n0.524868 0.705636 0.579299 O\n0.024868 0.294364 0.920701 O\n0.475132 0.294364 0.420701 O\n0.830644 0.495948 0.363510 O\n0.669356 0.495948 0.863510 O\n0.169356 0.504052 0.636490 O\n0.330644 0.504052 0.136490 O\n0.886716 0.274686 0.542895 O\n0.613284 0.274686 0.042895 O\n0.113284 0.725314 0.457105 O\n0.386716 0.725314 0.957105 O\n0.758604 0.335227 0.540213 O\n0.741396 0.335227 0.040213 O\n0.241396 0.664773 0.459787 O\n0.258604 0.664773 0.959787 O\n0.063901 0.362822 0.338693 O\n0.436099 0.362822 0.838693 O\n0.936099 0.637178 0.661307 O\n0.563901 0.637178 0.161307 O\n0.813870 0.988642 0.362928 O\n0.686130 0.988642 0.862928 O\n0.186130 0.011358 0.637072 O\n0.313870 0.011358 0.137072 O\n",
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{
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"structure_string": "Li2 Mn6 O2 F10\n1.0\n6.303757 0.000000 0.000000\n-0.215416 6.354566 0.000000\n-0.267243 -0.254842 6.349434\nLi Mn O F\n2 6 2 10\ndirect\n0.491697 0.502549 0.517358 Li\n0.003415 0.015034 0.023901 Li\n0.728962 0.444881 0.915734 Mn\n0.065517 0.243687 0.548074 Mn\n0.587364 0.076075 0.261284 Mn\n0.436721 0.904636 0.751839 Mn\n0.929624 0.761764 0.426607 Mn\n0.261935 0.564167 0.057268 Mn\n0.909133 0.063883 0.319185 O\n0.461727 0.594809 0.818436 O\n0.682989 0.096390 0.912411 F\n0.062423 0.310484 0.902173 F\n0.404247 0.180173 0.544509 F\n0.821034 0.475424 0.585941 F\n0.188109 0.538331 0.390789 F\n0.542512 0.401372 0.203313 F\n0.091136 0.916896 0.702836 F\n0.581728 0.797618 0.452298 F\n0.932795 0.680853 0.077189 F\n0.316933 0.930971 0.088852 F\n",
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{
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"structure_string": "Li5 Mn3 Ni2 O10\n1.0\n5.045549 0.000000 0.000000\n-0.845899 5.075036 0.000000\n-1.764697 -2.670298 7.179740\nLi Mn Ni O\n5 3 2 10\ndirect\n0.773133 0.508840 0.424358 Li\n0.626833 0.515869 0.764637 Li\n0.000000 0.000000 0.500000 Li\n0.373167 0.484131 0.235363 Li\n0.226867 0.491160 0.575642 Li\n0.000000 0.500000 0.000000 Mn\n0.796376 0.003341 0.894249 Mn\n0.203624 0.996659 0.105751 Mn\n0.416054 0.004161 0.683591 Ni\n0.583946 0.995839 0.316409 Ni\n0.166973 0.239962 0.871891 O\n0.406010 0.782901 0.955839 O\n0.590708 0.755597 0.551492 O\n0.017708 0.241694 0.218282 O\n0.800259 0.232591 0.673399 O\n0.199741 0.767409 0.326601 O\n0.982292 0.758306 0.781718 O\n0.409292 0.244403 0.448508 O\n0.593990 0.217099 0.044161 O\n0.833027 0.760038 0.128109 O\n",
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{
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"structure_string": "Na2 Tl1 Ag1 F6\n1.0\n0.000000 4.535133 4.535133\n4.535133 0.000000 4.535133\n4.535133 4.535133 0.000000\nNa Tl Ag F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Ag\n0.757447 0.242553 0.242553 F\n0.242553 0.242553 0.757447 F\n0.242553 0.757447 0.757447 F\n0.242553 0.757447 0.242553 F\n0.757447 0.242553 0.757447 F\n0.757447 0.757447 0.242553 F\n",
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{
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