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{
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{
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"structure_string": "Nd4 Mn2 Cr2 O12\n1.0\n5.775342 0.000000 0.000000\n0.000000 5.536723 0.000000\n0.000000 5.480805 7.645947\nNd Mn Cr O\n4 2 2 12\ndirect\n0.560621 0.735338 0.750236 Nd\n0.060621 0.264662 0.749764 Nd\n0.439379 0.264662 0.249764 Nd\n0.939379 0.735338 0.250236 Nd\n0.500000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Cr\n0.000000 0.500000 0.000000 Cr\n0.805025 0.257613 0.950106 O\n0.305025 0.742387 0.549894 O\n0.204874 0.348073 0.453003 O\n0.704874 0.651927 0.046997 O\n0.194975 0.742387 0.049894 O\n0.694975 0.257613 0.450106 O\n0.795126 0.651927 0.546997 O\n0.295126 0.348073 0.953003 O\n0.972082 0.849979 0.743993 O\n0.472082 0.150021 0.756007 O\n0.027918 0.150021 0.256007 O\n0.527918 0.849979 0.243993 O\n",
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{
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{
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"structure_string": "Mn6 Fe6 N10\n1.0\n5.460528 -0.124843 0.142359\n-0.804623 5.879413 -0.359545\n-1.689896 -2.714757 6.831806\nMn Fe N\n6 6 10\ndirect\n0.826271 0.413108 0.599702 Mn\n0.173729 0.586892 0.400298 Mn\n0.582855 0.876757 0.855715 Mn\n0.417145 0.123243 0.144285 Mn\n0.711766 0.553123 0.210592 Mn\n0.288234 0.446877 0.789408 Mn\n0.030768 0.272248 0.018440 Fe\n0.969232 0.727752 0.981560 Fe\n0.717016 0.945055 0.541762 Fe\n0.282984 0.054946 0.458238 Fe\n0.127458 0.918099 0.726632 Fe\n0.872542 0.081901 0.273368 Fe\n0.993853 0.196562 0.755198 N\n0.006147 0.803438 0.244802 N\n0.853059 0.661535 0.500207 N\n0.146941 0.338465 0.499793 N\n0.651134 0.558243 0.798948 N\n0.348866 0.441757 0.201052 N\n0.411857 0.877376 0.609350 N\n0.588143 0.122624 0.390650 N\n0.271912 0.796106 0.921163 N\n0.728088 0.203894 0.078837 N\n",
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"density": 6.216524494368613,
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"volume": 214.96644491443024,
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"formula_full": "Mn6 Fe6 N10",
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},
{
"id": "mp-1228388",
"created_at": "2022-09-04T14:47:17.820675Z",
"structure_string": "Ba6 Ti2 Nb8 O30\n1.0\n12.739758 0.000000 0.000000\n0.000000 4.124253 0.000000\n0.000000 0.028725 12.674583\nBa Ti Nb O\n6 2 8 30\ndirect\n0.752810 0.967991 0.504794 Ba\n0.247190 0.967991 0.004794 Ba\n0.927843 0.958254 0.169798 Ba\n0.583793 0.948705 0.824435 Ba\n0.416207 0.948705 0.324435 Ba\n0.072157 0.958254 0.669798 Ba\n0.831036 0.498610 0.713378 Ti\n0.168964 0.498610 0.213378 Ti\n0.676143 0.489227 0.284209 Nb\n0.323857 0.489227 0.784209 Nb\n0.541288 0.484968 0.575864 Nb\n0.964254 0.485960 0.425134 Nb\n0.458712 0.484968 0.075864 Nb\n0.035746 0.485960 0.925134 Nb\n0.748838 0.398978 0.993555 Nb\n0.251162 0.398978 0.493555 Nb\n0.829575 0.925905 0.706472 O\n0.672004 0.943327 0.294541 O\n0.327996 0.943327 0.794541 O\n0.170425 0.925905 0.206472 O\n0.541512 0.943219 0.578344 O\n0.956374 0.944066 0.422142 O\n0.458488 0.943219 0.078344 O\n0.043626 0.944066 0.922142 O\n0.751067 0.947987 0.999340 O\n0.248933 0.947987 0.499340 O\n0.093196 0.451784 0.508832 O\n0.405174 0.451007 0.492544 O\n0.594826 0.451007 0.992544 O\n0.906804 0.451784 0.008832 O\n0.746172 0.447638 0.841922 O\n0.756973 0.450643 0.156393 O\n0.253828 0.447638 0.341922 O\n0.243027 0.450643 0.656393 O\n0.890597 0.443379 0.569293 O\n0.609243 0.442343 0.433095 O\n0.390757 0.442343 0.933095 O\n0.109403 0.443379 0.069293 O\n0.679022 0.445580 0.642458 O\n0.817404 0.443455 0.361310 O\n0.320978 0.445580 0.142458 O\n0.182596 0.443455 0.861310 O\n0.031058 0.445795 0.282960 O\n0.466830 0.440177 0.719187 O\n0.533170 0.440177 0.219187 O\n0.968942 0.445795 0.782960 O\n",
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]
}