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{
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{
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{
"id": "mp-1221967",
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"structure_string": "Mg1 Fe1 Si2 O6\n1.0\n1.361709 -4.683833 0.000000\n1.361709 4.683833 0.000000\n0.000000 0.000000 6.741187\nMg Fe Si O\n1 1 2 6\ndirect\n0.263247 0.736753 0.500000 Mg\n0.739278 0.260722 0.000000 Fe\n0.999550 0.000450 0.250524 Si\n0.999550 0.000450 0.749476 Si\n0.376024 0.623976 0.798871 O\n0.626275 0.373725 0.695733 O\n0.376024 0.623976 0.201129 O\n0.626275 0.373725 0.304267 O\n0.064168 0.935832 0.000000 O\n0.929608 0.070392 0.500000 O\n",
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{
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"created_at": "2022-09-04T14:41:06.461562Z",
"structure_string": "As4 H72 N12 O28\n1.0\n6.366182 0.000000 0.000000\n0.000000 6.790667 0.000000\n0.000000 1.638749 23.074660\nAs H N O\n4 72 12 28\ndirect\n0.860045 0.790479 0.842958 As\n0.360045 0.209521 0.657042 As\n0.139955 0.209521 0.157042 As\n0.639955 0.790479 0.342958 As\n0.891394 0.744749 0.640077 H\n0.391394 0.255251 0.859923 H\n0.108606 0.255251 0.359923 H\n0.608606 0.744749 0.140077 H\n0.969981 0.980318 0.657812 H\n0.469981 0.019682 0.842188 H\n0.030019 0.019682 0.342188 H\n0.530019 0.980318 0.157812 H\n0.888908 0.198421 0.784716 H\n0.388908 0.801579 0.715284 H\n0.111092 0.801579 0.215284 H\n0.611092 0.198421 0.284716 H\n0.960852 0.280857 0.715479 H\n0.460852 0.719143 0.784521 H\n0.039148 0.719143 0.284521 H\n0.539148 0.280857 0.215479 H\n0.724444 0.868463 0.010074 H\n0.224444 0.131537 0.489926 H\n0.275556 0.131537 0.989926 H\n0.775556 0.868463 0.510074 H\n0.658504 0.632530 0.028380 H\n0.158504 0.367470 0.471620 H\n0.341496 0.367470 0.971620 H\n0.841496 0.632530 0.528380 H\n0.799068 0.172452 0.993983 H\n0.299068 0.827548 0.506017 H\n0.200932 0.827548 0.006017 H\n0.700932 0.172452 0.493983 H\n0.950639 0.407078 0.617188 H\n0.450639 0.592922 0.882812 H\n0.049361 0.592922 0.382812 H\n0.549361 0.407078 0.117188 H\n0.882440 0.170821 0.896356 H\n0.382440 0.829179 0.603644 H\n0.117560 0.829179 0.103644 H\n0.617560 0.170821 0.396356 H\n0.888931 0.803497 0.710220 H\n0.388931 0.196503 0.789780 H\n0.111069 0.196503 0.289780 H\n0.611069 0.803497 0.210220 H\n0.711606 0.909327 0.661502 H\n0.211606 0.090673 0.838498 H\n0.288394 0.090673 0.338498 H\n0.788394 0.909327 0.161502 H\n0.893604 0.448855 0.765055 H\n0.393604 0.551145 0.734945 H\n0.106396 0.551145 0.234945 H\n0.606396 0.448855 0.265055 H\n0.704948 0.303583 0.736891 H\n0.204948 0.696417 0.763109 H\n0.295052 0.696417 0.263109 H\n0.795052 0.303583 0.236891 H\n0.775951 0.695924 0.961200 H\n0.275951 0.304076 0.538800 H\n0.224049 0.304076 0.038800 H\n0.724049 0.695924 0.461200 H\n0.523485 0.769645 0.975608 H\n0.023485 0.230355 0.524392 H\n0.476515 0.230355 0.024392 H\n0.976515 0.769645 0.475608 H\n0.848587 0.167876 0.060900 H\n0.348587 0.832124 0.439100 H\n0.151413 0.832124 0.939100 H\n0.651413 0.167876 0.560900 H\n0.707099 0.440926 0.604133 H\n0.207099 0.559074 0.895867 H\n0.292901 0.559074 0.395867 H\n0.792901 0.440926 0.104133 H\n0.893656 0.394626 0.915913 H\n0.393656 0.605374 0.584087 H\n0.106344 0.605374 0.084087 H\n0.606344 0.394626 0.415913 H\n0.868326 0.859413 0.666965 N\n0.368326 0.140587 0.833035 N\n0.131674 0.140587 0.333035 N\n0.631674 0.859413 0.166965 N\n0.862925 0.307928 0.750749 N\n0.362925 0.692072 0.749251 N\n0.137075 0.692072 0.249251 N\n0.637075 0.307928 0.250749 N\n0.671376 0.737899 0.993303 N\n0.171376 0.262101 0.506697 N\n0.328624 0.262101 0.006697 N\n0.828624 0.737899 0.493303 N\n0.941678 0.691332 0.780118 O\n0.441678 0.308668 0.719882 O\n0.058322 0.308668 0.219882 O\n0.558322 0.691332 0.280118 O\n0.964402 0.660125 0.903473 O\n0.464402 0.339875 0.596527 O\n0.035598 0.339875 0.096527 O\n0.535598 0.660125 0.403473 O\n0.590228 0.785668 0.847782 O\n0.090228 0.214332 0.652218 O\n0.409772 0.214332 0.152218 O\n0.909772 0.785668 0.347782 O\n0.947283 0.031207 0.842167 O\n0.447283 0.968793 0.657833 O\n0.052717 0.968793 0.157833 O\n0.552717 0.031207 0.342167 O\n0.749495 0.114227 0.032930 O\n0.249495 0.885773 0.467070 O\n0.250505 0.885773 0.967070 O\n0.750505 0.114227 0.532930 O\n0.847482 0.508752 0.601708 O\n0.347482 0.491248 0.898292 O\n0.152518 0.491248 0.398292 O\n0.652518 0.508752 0.101708 O\n0.846026 0.259609 0.927809 O\n0.346026 0.740391 0.572191 O\n0.153974 0.740391 0.072191 O\n0.653974 0.259609 0.427809 O\n",
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{
"id": "mp-1175401",
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"structure_string": "Li9 Co7 O16\n1.0\n5.016700 0.000000 0.000000\n0.811485 5.017742 0.000000\n0.778668 1.723923 10.931871\nLi Co O\n9 7 16\ndirect\n0.745845 0.195717 0.818986 Li\n0.245911 0.059555 0.941568 Li\n0.252950 0.311033 0.689004 Li\n0.749476 0.439628 0.563918 Li\n0.250524 0.560372 0.436082 Li\n0.747050 0.688967 0.310996 Li\n0.254155 0.804283 0.181014 Li\n0.754089 0.940445 0.058432 Li\n0.500000 0.500000 0.000000 Li\n0.999813 0.625183 0.875818 Co\n0.000187 0.374817 0.124182 Co\n0.500340 0.255424 0.244124 Co\n0.001298 0.127970 0.372561 Co\n0.500000 0.000000 0.500000 Co\n0.998702 0.872030 0.627439 Co\n0.499660 0.744576 0.755876 Co\n0.143286 0.941273 0.780017 O\n0.638625 0.828076 0.891706 O\n0.621604 0.068398 0.657909 O\n0.120238 0.210265 0.529503 O\n0.619479 0.328361 0.399767 O\n0.144629 0.448803 0.273858 O\n0.640534 0.551794 0.162642 O\n0.104981 0.694803 0.028588 O\n0.359466 0.448206 0.837358 O\n0.895019 0.305197 0.971412 O\n0.855371 0.551197 0.726142 O\n0.380521 0.671639 0.600233 O\n0.879762 0.789735 0.470497 O\n0.378396 0.931602 0.342091 O\n0.856714 0.058727 0.219983 O\n0.361375 0.171924 0.108294 O\n",
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{
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{
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{
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