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{
"id": "mp-1213558",
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"volume": 1390.4743871348057,
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"formula_full": "Eu4 Hf4 Mo14 O56",
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"spacegroup": 15
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{
"id": "mp-1245364",
"created_at": "2022-09-04T14:40:25.858519Z",
"structure_string": "Zr20 Si12 N36\n1.0\n7.411173 -0.057385 0.000000\n-7.983626 7.446639 0.000000\n0.000000 0.000000 14.594689\nZr Si N\n20 12 36\ndirect\n0.000000 0.498645 0.827720 Zr\n0.000000 0.501355 0.172280 Zr\n0.000000 0.001355 0.327720 Zr\n0.000000 0.998645 0.672280 Zr\n0.383823 0.953731 0.868103 Zr\n0.383823 0.430092 0.131897 Zr\n0.383823 0.930092 0.368103 Zr\n0.383823 0.453731 0.631897 Zr\n0.616177 0.046269 0.131897 Zr\n0.616177 0.569908 0.868103 Zr\n0.616177 0.069908 0.631897 Zr\n0.616177 0.546269 0.368103 Zr\n0.000000 0.498808 0.596552 Zr\n0.000000 0.501192 0.403448 Zr\n0.000000 0.001192 0.096552 Zr\n0.000000 0.998808 0.903448 Zr\n0.614214 0.307107 0.000000 Zr\n0.614214 0.807107 0.500000 Zr\n0.385786 0.692893 0.000000 Zr\n0.385786 0.192893 0.500000 Zr\n0.000000 0.758585 0.015023 Si\n0.000000 0.241415 0.984977 Si\n0.000000 0.741415 0.515023 Si\n0.000000 0.258585 0.484977 Si\n0.000000 0.238493 0.781798 Si\n0.000000 0.761507 0.218202 Si\n0.000000 0.261507 0.281798 Si\n0.000000 0.738493 0.718202 Si\n0.500000 0.781371 0.750000 Si\n0.500000 0.718629 0.250000 Si\n0.500000 0.218629 0.250000 Si\n0.500000 0.281371 0.750000 Si\n0.000000 0.346811 0.696582 N\n0.000000 0.653189 0.303418 N\n0.000000 0.153189 0.196582 N\n0.000000 0.846811 0.803418 N\n0.000000 0.310211 0.882878 N\n0.000000 0.689789 0.117122 N\n0.000000 0.189789 0.382878 N\n0.000000 0.810211 0.617122 N\n0.742568 0.511301 0.732037 N\n0.742568 0.231269 0.267963 N\n0.742568 0.731269 0.232037 N\n0.742568 0.011301 0.767963 N\n0.257432 0.488699 0.267963 N\n0.257432 0.768731 0.732037 N\n0.257432 0.268731 0.767963 N\n0.257432 0.988699 0.232037 N\n0.548896 0.226244 0.849100 N\n0.548896 0.322653 0.150900 N\n0.548896 0.822653 0.349100 N\n0.548896 0.726244 0.650900 N\n0.451104 0.773756 0.150900 N\n0.451104 0.677347 0.849100 N\n0.451104 0.177347 0.650900 N\n0.451104 0.273756 0.349100 N\n0.265202 0.995790 0.000605 N\n0.265202 0.269411 0.999395 N\n0.265202 0.769411 0.500605 N\n0.265202 0.495790 0.499395 N\n0.734798 0.004210 0.999395 N\n0.734798 0.730589 0.000605 N\n0.734798 0.230589 0.499395 N\n0.734798 0.504210 0.500605 N\n0.000000 0.642487 0.933339 N\n0.000000 0.357513 0.066661 N\n0.000000 0.857513 0.433339 N\n0.000000 0.142487 0.566661 N\n",
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"Si",
"N"
],
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"density": 5.541741478896808,
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"volume": 798.770094948702,
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"formula_full": "Zr20 Si12 N36",
"formula_reduced": "Zr5(SiN3)3",
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"spacegroup": 64
},
{
"id": "mp-1077889",
"created_at": "2022-09-04T14:40:32.966947Z",
"structure_string": "Ir2 C4\n1.0\n1.382765 3.381082 0.000000\n-1.382765 3.381082 0.000000\n0.000000 2.299808 7.491741\nIr C\n2 4\ndirect\n0.135292 0.135292 0.708273 Ir\n0.864708 0.864708 0.291727 Ir\n0.816638 0.816638 0.788405 C\n0.183362 0.183362 0.211595 C\n0.596414 0.596414 0.516287 C\n0.403586 0.403586 0.483713 C\n",
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],
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"density": 10.251680907895926,
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"volume": 70.05140213104313,
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"formula_full": "Ir2 C4",
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{
"id": "mp-1221298",
"created_at": "2022-09-04T14:40:34.730362Z",
"structure_string": "Na2 U1 I6\n1.0\n0.000000 6.259867 8.004669\n5.054443 0.000000 8.004669\n5.054443 6.259867 0.000000\nNa U I\n2 1 6\ndirect\n0.000000 0.000000 0.500000 Na\n0.500000 0.500000 0.000000 Na\n0.000000 0.000000 0.000000 U\n0.050231 0.694070 0.305930 I\n0.305930 0.949769 0.050231 I\n0.698287 0.301713 0.301713 I\n0.949769 0.305930 0.694070 I\n0.694070 0.050231 0.949769 I\n0.301713 0.698287 0.698287 I\n",
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{
"id": "mp-1176044",
"created_at": "2022-09-04T14:40:25.828656Z",
"structure_string": "Li9 Mn2 Co5 O16\n1.0\n5.132206 0.000000 0.000000\n0.021128 5.856188 0.000000\n1.740434 0.057123 9.545574\nLi Mn Co O\n9 2 5 16\ndirect\n0.500237 0.250524 0.003510 Li\n0.250261 0.490548 0.250673 Li\n0.502367 0.753231 0.002247 Li\n0.248449 0.007570 0.249648 Li\n0.752336 0.000663 0.749337 Li\n0.747628 0.499706 0.751613 Li\n0.998027 0.749450 0.498871 Li\n0.999426 0.246814 0.495636 Li\n0.749408 0.247307 0.249371 Li\n0.001513 0.004710 0.003827 Mn\n0.495866 0.998162 0.495785 Mn\n0.514742 0.493714 0.488833 Co\n0.250805 0.746520 0.750883 Co\n0.992572 0.499341 0.009880 Co\n0.749514 0.753401 0.249885 Co\n0.249600 0.253478 0.748455 Co\n0.347548 0.010864 0.873441 O\n0.123189 0.240032 0.114740 O\n0.356332 0.503602 0.874062 O\n0.123833 0.765862 0.115654 O\n0.598600 0.758152 0.621943 O\n0.612408 0.234163 0.614949 O\n0.849408 0.512348 0.375905 O\n0.835163 0.983066 0.376846 O\n0.654910 0.520008 0.126397 O\n0.375581 0.758272 0.384487 O\n0.663305 0.989832 0.121005 O\n0.376490 0.236956 0.385384 O\n0.886748 0.242666 0.884866 O\n0.900763 0.764047 0.878054 O\n0.151460 0.995969 0.622566 O\n0.141510 0.489025 0.631248 O\n",
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"elements": [
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],
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"density": 4.184727043461813,
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"formula_full": "Li9 Mn2 Co5 O16",
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},
{
"id": "mp-695791",
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"structure_string": "Li4 Mo4 P20 O60\n1.0\n13.827080 0.000000 0.000000\n0.000000 9.465863 0.000000\n0.000000 3.961552 9.871246\nLi Mo P O\n4 4 20 60\ndirect\n0.132805 0.073298 0.234519 Li\n0.632805 0.926702 0.265481 Li\n0.367195 0.073298 0.734519 Li\n0.867195 0.926702 0.765481 Li\n0.000771 0.498203 0.251801 Mo\n0.499229 0.498203 0.751801 Mo\n0.500771 0.501797 0.248199 Mo\n0.999229 0.501797 0.748199 Mo\n0.413055 0.823359 0.015873 P\n0.251187 0.015282 0.514035 P\n0.575739 0.183014 0.494160 P\n0.141760 0.523336 0.989916 P\n0.748813 0.984718 0.485965 P\n0.643380 0.474024 0.007568 P\n0.358240 0.523336 0.489916 P\n0.075739 0.816986 0.005840 P\n0.356620 0.525976 0.992432 P\n0.924261 0.183014 0.994160 P\n0.086945 0.823359 0.515873 P\n0.424261 0.816986 0.505840 P\n0.143380 0.525976 0.492432 P\n0.856620 0.474024 0.507568 P\n0.858240 0.476664 0.010084 P\n0.751187 0.984718 0.985965 P\n0.586945 0.176641 0.984127 P\n0.248813 0.015282 0.014035 P\n0.641760 0.476664 0.510084 P\n0.913055 0.176641 0.484127 P\n0.656002 0.105209 0.438819 O\n0.478051 0.714675 0.636288 O\n0.019494 0.722687 0.630250 O\n0.077885 0.434842 0.108833 O\n0.978051 0.285325 0.863712 O\n0.843998 0.105209 0.938819 O\n0.649642 0.300642 0.029674 O\n0.519494 0.277313 0.869750 O\n0.422296 0.438462 0.108752 O\n0.750836 0.533411 0.965467 O\n0.850358 0.300642 0.529674 O\n0.980506 0.277313 0.369750 O\n0.123098 0.504616 0.359790 O\n0.343998 0.894791 0.561181 O\n0.514614 0.090682 0.607856 O\n0.643481 0.302039 0.537963 O\n0.876902 0.495384 0.640210 O\n0.922115 0.565158 0.891167 O\n0.377927 0.501536 0.357363 O\n0.266709 0.069541 0.866025 O\n0.749164 0.533411 0.465467 O\n0.422115 0.434842 0.608833 O\n0.856519 0.302039 0.037963 O\n0.122073 0.501536 0.857363 O\n0.877927 0.498464 0.142637 O\n0.666050 0.115433 0.908932 O\n0.356519 0.697961 0.462037 O\n0.077704 0.438462 0.608752 O\n0.544256 0.064661 0.107973 O\n0.250836 0.466589 0.534533 O\n0.014614 0.909318 0.892144 O\n0.376902 0.504616 0.859790 O\n0.333950 0.884567 0.091068 O\n0.622073 0.498464 0.642637 O\n0.233319 0.115455 0.090703 O\n0.733319 0.884545 0.409297 O\n0.577704 0.561538 0.891248 O\n0.577885 0.565158 0.391167 O\n0.350358 0.699358 0.970326 O\n0.833950 0.115433 0.408932 O\n0.922296 0.561538 0.391248 O\n0.623098 0.495384 0.140210 O\n0.156002 0.894791 0.061181 O\n0.766681 0.884545 0.909297 O\n0.955744 0.064661 0.607973 O\n0.143481 0.697961 0.962037 O\n0.249164 0.466589 0.034533 O\n0.485386 0.909318 0.392144 O\n0.266681 0.115455 0.590703 O\n0.149642 0.699358 0.470326 O\n0.733291 0.930459 0.133975 O\n0.455744 0.935339 0.892027 O\n0.521949 0.285325 0.363712 O\n0.021949 0.714675 0.136288 O\n0.044256 0.935339 0.392027 O\n0.985386 0.090682 0.107856 O\n0.233291 0.069541 0.366025 O\n0.166050 0.884567 0.591068 O\n0.766709 0.930459 0.633975 O\n0.480506 0.722687 0.130250 O\n",
"nsites": 88,
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},
{
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