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{
"id": "mp-1111076",
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{
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"structure_string": "Li2 Mn4 P6 O24\n1.0\n6.098278 5.917808 0.000000\n-6.098278 5.917808 0.000000\n0.000000 2.412527 5.698593\nLi Mn P O\n2 4 6 24\ndirect\n0.500000 0.500000 0.500000 Li\n0.500000 0.500000 0.000000 Li\n0.059438 0.379999 0.362726 Mn\n0.379999 0.059438 0.862726 Mn\n0.620001 0.940562 0.137274 Mn\n0.940562 0.620001 0.637274 Mn\n0.724084 0.275916 0.750000 P\n0.838905 0.647944 0.141336 P\n0.647944 0.838905 0.641336 P\n0.352056 0.161095 0.358664 P\n0.275916 0.724084 0.250000 P\n0.161095 0.352056 0.858664 P\n0.969051 0.643859 0.910217 O\n0.940730 0.589901 0.330043 O\n0.850755 0.257114 0.525976 O\n0.742886 0.149245 0.974024 O\n0.030949 0.356141 0.089783 O\n0.059270 0.410099 0.669957 O\n0.149245 0.742886 0.474024 O\n0.257114 0.850755 0.025976 O\n0.166969 0.188974 0.391724 O\n0.253344 0.546344 0.226259 O\n0.188974 0.166969 0.891724 O\n0.316887 0.461522 0.787472 O\n0.410099 0.059270 0.169957 O\n0.453656 0.746656 0.273741 O\n0.356141 0.030949 0.589783 O\n0.461522 0.316887 0.287472 O\n0.538478 0.683113 0.712528 O\n0.643859 0.969051 0.410217 O\n0.546344 0.253344 0.726259 O\n0.589901 0.940730 0.830043 O\n0.683113 0.538478 0.212528 O\n0.811026 0.833031 0.108276 O\n0.746656 0.453656 0.773741 O\n0.833031 0.811026 0.608276 O\n",
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"formula_full": "Li2 Mn4 P6 O24",
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{
"id": "mp-770522",
"created_at": "2022-09-04T14:46:12.084713Z",
"structure_string": "Li8 Al4 V4 O16\n1.0\n5.087711 0.000000 0.000000\n0.000000 6.491372 0.000000\n0.000000 0.000000 11.070090\nLi Al V O\n8 4 4 16\ndirect\n0.244436 0.869003 0.080823 Li\n0.690607 0.117302 0.163630 Li\n0.190607 0.617302 0.336370 Li\n0.744436 0.369003 0.419177 Li\n0.255564 0.869003 0.580823 Li\n0.809393 0.117302 0.663630 Li\n0.309393 0.617302 0.836370 Li\n0.755564 0.369003 0.919177 Li\n0.184264 0.366493 0.085305 Al\n0.684264 0.866493 0.414695 Al\n0.315736 0.366493 0.585305 Al\n0.815736 0.866493 0.914695 Al\n0.688497 0.619595 0.168234 V\n0.188497 0.119595 0.331766 V\n0.811503 0.619595 0.668234 V\n0.311503 0.119595 0.831766 V\n0.746858 0.860685 0.071487 O\n0.833084 0.375001 0.094689 O\n0.303722 0.592559 0.158598 O\n0.293658 0.141456 0.163372 O\n0.793658 0.641456 0.336628 O\n0.803722 0.092559 0.341402 O\n0.333084 0.875001 0.405311 O\n0.246858 0.360685 0.428513 O\n0.753142 0.860685 0.571487 O\n0.666916 0.375001 0.594689 O\n0.196278 0.592559 0.658598 O\n0.206342 0.141456 0.663372 O\n0.706342 0.641456 0.836628 O\n0.696278 0.092559 0.841402 O\n0.166916 0.875001 0.905311 O\n0.253142 0.360685 0.928513 O\n",
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"formula_full": "Li8 Al4 V4 O16",
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{
"id": "mp-26741",
"created_at": "2022-09-04T14:47:26.271744Z",
"structure_string": "Li2 Cu8 P6 O24\n1.0\n6.083134 5.986789 0.000000\n-6.083134 5.986789 0.000000\n0.000000 3.614251 6.274315\nLi Cu P O\n2 8 6 24\ndirect\n0.995945 0.004056 0.750000 Li\n0.004055 0.995945 0.250000 Li\n0.938694 0.619033 0.645368 Cu\n0.619033 0.938694 0.145368 Cu\n0.506535 0.493465 0.750000 Cu\n0.733908 0.266092 0.250000 Cu\n0.493465 0.506535 0.250000 Cu\n0.061306 0.380967 0.354632 Cu\n0.266092 0.733908 0.750000 Cu\n0.380967 0.061306 0.854632 Cu\n0.722028 0.277972 0.750000 P\n0.887820 0.659265 0.116431 P\n0.112180 0.340735 0.883569 P\n0.277972 0.722028 0.250000 P\n0.340735 0.112180 0.383569 P\n0.659265 0.887820 0.616431 P\n0.410198 0.039973 0.208498 O\n0.468160 0.730617 0.242324 O\n0.168243 0.169550 0.389497 O\n0.264086 0.479490 0.833073 O\n0.479490 0.264086 0.333073 O\n0.039973 0.410198 0.708498 O\n0.269383 0.531840 0.257676 O\n0.830450 0.831757 0.110503 O\n0.983000 0.306474 0.112781 O\n0.730617 0.468160 0.742324 O\n0.169550 0.168243 0.889497 O\n0.747921 0.164029 0.949669 O\n0.589802 0.960027 0.791502 O\n0.252079 0.835971 0.050331 O\n0.835971 0.252079 0.550331 O\n0.693526 0.017000 0.387219 O\n0.306474 0.983000 0.612781 O\n0.531840 0.269383 0.757676 O\n0.960027 0.589802 0.291502 O\n0.735914 0.520510 0.166927 O\n0.164029 0.747921 0.449669 O\n0.520510 0.735914 0.666927 O\n0.017000 0.693526 0.887219 O\n0.831757 0.830450 0.610503 O\n",
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"formula_full": "Li2 Cu8 P6 O24",
"formula_reduced": "LiCu4(PO4)3",
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{
"id": "mp-752613",
"created_at": "2022-09-04T14:41:06.203833Z",
"structure_string": "Co4 Sn4 O12\n1.0\n5.394922 0.000000 0.000000\n0.000000 5.422766 0.000000\n0.000000 0.000000 7.810530\nCo Sn O\n4 4 12\ndirect\n0.027422 0.013487 0.750000 Co\n0.527422 0.486513 0.750000 Co\n0.472578 0.513487 0.250000 Co\n0.972578 0.986513 0.250000 Co\n0.500000 0.000000 0.000000 Sn\n0.500000 0.000000 0.500000 Sn\n0.000000 0.500000 0.000000 Sn\n0.000000 0.500000 0.500000 Sn\n0.593919 0.875068 0.250000 O\n0.831827 0.834778 0.566755 O\n0.831827 0.834778 0.933245 O\n0.331827 0.665222 0.566755 O\n0.331827 0.665222 0.933245 O\n0.093919 0.624932 0.250000 O\n0.906081 0.375068 0.750000 O\n0.668173 0.334778 0.066755 O\n0.668173 0.334778 0.433245 O\n0.168173 0.165222 0.066755 O\n0.168173 0.165222 0.433245 O\n0.406081 0.124932 0.750000 O\n",
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"density": 6.559055799122409,
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"volume": 228.5001761928931,
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"formula_full": "Co4 Sn4 O12",
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{
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"created_at": "2022-09-04T14:42:57.950205Z",
"structure_string": "Nd1 Mn4 Co1 O12\n1.0\n0.000000 -3.656176 -3.631760\n0.000000 -3.656176 3.631760\n-7.743778 0.000000 0.000000\nNd Mn Co O\n1 4 1 12\ndirect\n0.968878 0.031122 -0.000000 Nd\n0.499763 0.998761 0.260322 Mn\n0.499763 0.998761 0.739678 Mn\n0.001239 0.500237 0.739678 Mn\n0.001239 0.500237 0.260322 Mn\n0.524580 0.475420 0.500000 Co\n0.181753 0.177952 0.253916 O\n0.822048 0.818247 0.253916 O\n0.822048 0.818247 0.746084 O\n0.181753 0.177952 0.746084 O\n0.333722 0.666278 0.327094 O\n0.693660 0.306340 0.197906 O\n0.693660 0.306340 0.802094 O\n0.333722 0.666278 0.672906 O\n0.457182 0.937784 -0.000000 O\n0.523172 0.111399 0.500000 O\n0.062216 0.542818 -0.000000 O\n0.888601 0.476828 0.500000 O\n",
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{
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"structure_string": "Al2 Mo2 W4 O16\n1.0\n5.681989 0.000000 0.000000\n0.000000 5.211670 0.000000\n0.000000 4.942585 9.259466\nAl Mo W O\n2 2 4 16\ndirect\n0.661401 0.000000 0.250000 Al\n0.338599 0.000000 0.750000 Al\n0.361257 0.500000 0.250000 Mo\n0.638743 0.500000 0.750000 Mo\n0.159272 0.252688 0.998577 W\n0.159272 0.747312 0.501423 W\n0.840728 0.747312 0.001423 W\n0.840728 0.252688 0.498577 W\n0.385135 0.745755 0.367563 O\n0.385135 0.254245 0.132437 O\n0.614865 0.254245 0.632437 O\n0.614865 0.745755 0.867563 O\n0.891481 0.191704 0.890265 O\n0.891481 0.808296 0.609735 O\n0.108519 0.808296 0.109735 O\n0.108519 0.191704 0.390265 O\n0.633481 0.197522 0.360438 O\n0.633481 0.802478 0.139562 O\n0.366519 0.802478 0.639562 O\n0.366519 0.197522 0.860438 O\n0.876199 0.694098 0.384738 O\n0.123801 0.305902 0.615262 O\n0.876199 0.305902 0.115262 O\n0.123801 0.694098 0.884738 O\n",
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{
"id": "mp-1194636",
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"structure_string": "Mo8 H24 N4 O30\n1.0\n7.919120 -0.013242 -1.428505\n-3.633325 8.789473 -4.202205\n0.102531 -0.073629 10.862734\nMo H N O\n8 24 4 30\ndirect\n0.255203 0.448653 0.436373 Mo\n0.744797 0.551347 0.563627 Mo\n0.403095 0.180840 0.423069 Mo\n0.596905 0.819160 0.576931 Mo\n0.619818 0.377421 0.772908 Mo\n0.380182 0.622579 0.227092 Mo\n0.465806 0.646997 0.779924 Mo\n0.534194 0.353003 0.220076 Mo\n0.856998 0.170198 0.322496 H\n0.143002 0.829802 0.677504 H\n0.660745 0.040018 0.243889 H\n0.339255 0.959982 0.756111 H\n0.806174 0.752403 0.043607 H\n0.193826 0.247597 0.956393 H\n0.870226 0.924268 0.162054 H\n0.129774 0.075732 0.837946 H\n0.023608 0.200942 0.741286 H\n0.976392 0.799058 0.258714 H\n0.044412 0.188124 0.583581 H\n0.955588 0.811876 0.416419 H\n0.068366 0.355985 0.715359 H\n0.931634 0.644015 0.284641 H\n0.859805 0.212617 0.628692 H\n0.140195 0.787383 0.371308 H\n0.072870 0.842342 0.014447 H\n0.927130 0.157658 0.985553 H\n0.207721 0.886454 0.916374 H\n0.792279 0.113546 0.083626 H\n0.157090 0.716705 0.913707 H\n0.842910 0.283295 0.086293 H\n0.294357 0.877100 0.064230 H\n0.705643 0.122900 0.935770 H\n0.997805 0.238683 0.666666 N\n0.002195 0.761317 0.333334 N\n0.181762 0.830719 0.976004 N\n0.818238 0.169281 0.023996 N\n0.457199 0.433307 0.584814 O\n0.542801 0.566693 0.415186 O\n0.300585 0.270398 0.308977 O\n0.699415 0.729602 0.691023 O\n0.588936 0.216003 0.583216 O\n0.411064 0.783997 0.416784 O\n0.633826 0.589039 0.873444 O\n0.366174 0.410961 0.126556 O\n0.350616 0.654056 0.601920 O\n0.649384 0.345944 0.398080 O\n0.058034 0.353090 0.458355 O\n0.941966 0.646910 0.541645 O\n0.176964 0.496292 0.303349 O\n0.823036 0.503708 0.696651 O\n0.204356 0.104009 0.455267 O\n0.795644 0.895991 0.544733 O\n0.422620 0.027709 0.285247 O\n0.577380 0.972291 0.714753 O\n0.417081 0.288650 0.791992 O\n0.582919 0.711350 0.208008 O\n0.788673 0.365130 0.883723 O\n0.211327 0.634870 0.116277 O\n0.259199 0.555513 0.795755 O\n0.740801 0.444487 0.204245 O\n0.534862 0.836653 0.906194 O\n0.465138 0.163347 0.093806 O\n0.783568 0.071730 0.235618 O\n0.216432 0.928270 0.764382 O\n0.915446 0.842028 0.116813 O\n0.084554 0.157972 0.883187 O\n",
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{
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{
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{
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{
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"structure_string": "Li8 Cr2 P12 H16 O44\n1.0\n15.380470 0.000000 0.000000\n0.000000 7.485449 0.000000\n0.000000 0.592905 8.137089\nLi Cr P H O\n8 2 12 16 44\ndirect\n0.275725 0.467367 0.657509 Li\n0.386779 0.359427 0.110362 Li\n0.886779 0.140573 0.889638 Li\n0.775725 0.032633 0.342491 Li\n0.224275 0.967367 0.657509 Li\n0.113221 0.859427 0.110362 Li\n0.613221 0.640573 0.889638 Li\n0.724275 0.532633 0.342491 Li\n0.500000 0.500000 0.500000 Cr\n0.000000 0.000000 0.500000 Cr\n0.063296 0.436262 0.191721 P\n0.677746 0.260120 0.027435 P\n0.683352 0.336018 0.681498 P\n0.183352 0.163982 0.318502 P\n0.177746 0.239880 0.972565 P\n0.563296 0.063738 0.808279 P\n0.436704 0.936262 0.191721 P\n0.822254 0.760120 0.027435 P\n0.816648 0.836018 0.681498 P\n0.316648 0.663982 0.318502 P\n0.322254 0.739880 0.972565 P\n0.936704 0.563738 0.808279 P\n0.579108 0.371077 0.248221 H\n0.355360 0.267843 0.509874 H\n0.414409 0.250199 0.676192 H\n0.508710 0.229224 0.309523 H\n0.008710 0.270776 0.690477 H\n0.914409 0.249801 0.323808 H\n0.855360 0.232157 0.490126 H\n0.079108 0.128923 0.751779 H\n0.920892 0.871077 0.248221 H\n0.144640 0.767843 0.509874 H\n0.085591 0.750199 0.676192 H\n0.991290 0.729224 0.309523 H\n0.491290 0.770776 0.690477 H\n0.585591 0.749801 0.323808 H\n0.644640 0.732157 0.490126 H\n0.420892 0.628923 0.751779 H\n0.112708 0.396211 0.023386 O\n0.626720 0.427328 0.058955 O\n0.619139 0.484204 0.705735 O\n0.977666 0.342639 0.202110 O\n0.131127 0.350545 0.330182 O\n0.934711 0.364423 0.795195 O\n0.551356 0.317620 0.351052 O\n0.387395 0.337334 0.588741 O\n0.746464 0.355959 0.541723 O\n0.735276 0.295188 0.856987 O\n0.735772 0.183806 0.160061 O\n0.235772 0.316194 0.839939 O\n0.235276 0.204812 0.143013 O\n0.246464 0.144041 0.458277 O\n0.887395 0.162666 0.411259 O\n0.051356 0.182380 0.648948 O\n0.434711 0.135577 0.204805 O\n0.631127 0.149455 0.669818 O\n0.477666 0.157361 0.797890 O\n0.119139 0.015796 0.294265 O\n0.126720 0.072672 0.941045 O\n0.612708 0.103789 0.976614 O\n0.387292 0.896211 0.023386 O\n0.873280 0.927328 0.058955 O\n0.880861 0.984204 0.705735 O\n0.522334 0.842639 0.202110 O\n0.368873 0.850545 0.330182 O\n0.565289 0.864423 0.795195 O\n0.948644 0.817620 0.351052 O\n0.112605 0.837334 0.588741 O\n0.753536 0.855959 0.541723 O\n0.764724 0.795188 0.856987 O\n0.764228 0.683806 0.160061 O\n0.264228 0.816194 0.839939 O\n0.264724 0.704812 0.143013 O\n0.253536 0.644041 0.458277 O\n0.612605 0.662666 0.411259 O\n0.448644 0.682380 0.648948 O\n0.065289 0.635577 0.204805 O\n0.868873 0.649455 0.669818 O\n0.022334 0.657361 0.797890 O\n0.380861 0.515796 0.294265 O\n0.373280 0.572672 0.941045 O\n0.887292 0.603789 0.976614 O\n",
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}
]
}