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{
"id": "mp-1181155",
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"structure_string": "H4 N4 O4\n1.0\n2.995376 3.893082 0.000000\n-2.995376 3.893082 0.000000\n0.000000 3.880774 5.487152\nH N O\n4 4 4\ndirect\n0.149693 0.274483 0.534331 H\n0.725517 0.850307 0.965669 H\n0.850307 0.725517 0.465669 H\n0.274483 0.149693 0.034331 H\n0.193937 0.806063 0.250000 N\n0.806063 0.193937 0.750000 N\n0.394867 0.605133 0.250000 N\n0.605133 0.394867 0.750000 N\n0.376366 0.300534 0.406802 O\n0.699466 0.623634 0.093198 O\n0.623634 0.699466 0.593198 O\n0.300534 0.376366 0.906802 O\n",
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{
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"structure_string": "Ca8 Te2 N8\n1.0\n6.146979 -0.165182 0.276661\n2.158789 5.721147 -0.436128\n2.011947 1.600093 9.107000\nCa Te N\n8 2 8\ndirect\n0.763643 0.565495 0.196850 Ca\n0.236357 0.434505 0.803150 Ca\n0.744409 0.221425 0.980541 Ca\n0.255591 0.778575 0.019459 Ca\n0.727188 0.475274 0.570538 Ca\n0.272812 0.524726 0.429462 Ca\n0.246344 0.987898 0.567177 Ca\n0.753656 0.012102 0.432823 Ca\n0.723901 0.831131 0.798425 Te\n0.276099 0.168869 0.201575 Te\n0.972513 0.738357 0.619226 N\n0.027487 0.261643 0.380774 N\n0.919418 0.781726 0.952234 N\n0.080582 0.218274 0.047766 N\n0.566871 0.575085 0.827333 N\n0.433129 0.424915 0.172667 N\n0.550445 0.755564 0.408454 N\n0.449555 0.244436 0.591546 N\n",
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{
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"structure_string": "Hf1 Fe2 Sn1\n1.0\n0.000000 3.106635 3.106635\n3.106635 0.000000 3.106635\n3.106635 3.106635 0.000000\nHf Fe Sn\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Hf\n0.250000 0.250000 0.250000 Fe\n0.750000 0.750000 0.750000 Fe\n0.000000 0.000000 0.000000 Sn\n",
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{
"id": "mp-766711",
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"structure_string": "Li16 Si8 Ni8 O32\n1.0\n4.981876 0.000000 0.000000\n0.000000 10.206684 0.000000\n0.000000 0.000000 13.313734\nLi Si Ni O\n16 8 8 32\ndirect\n0.021394 0.978132 0.552417 Li\n0.515538 0.004874 0.944039 Li\n0.010386 0.213432 0.191864 Li\n0.540070 0.179402 0.292311 Li\n0.010386 0.286568 0.691864 Li\n0.540070 0.320598 0.792311 Li\n0.515538 0.495126 0.444039 Li\n0.021394 0.521868 0.052417 Li\n0.484462 0.504874 0.944039 Li\n0.978606 0.478131 0.552417 Li\n0.459930 0.679402 0.292311 Li\n0.989614 0.713432 0.191864 Li\n0.459930 0.820598 0.792311 Li\n0.989614 0.786568 0.691864 Li\n0.978606 0.021868 0.052417 Li\n0.484462 0.995126 0.444039 Li\n0.015002 0.021940 0.810781 Si\n0.511678 0.229030 0.068660 Si\n0.511678 0.270970 0.568660 Si\n0.015002 0.478060 0.310781 Si\n0.984998 0.521940 0.810781 Si\n0.488322 0.729030 0.068660 Si\n0.488322 0.770970 0.568660 Si\n0.984998 0.978060 0.310781 Si\n0.512112 0.034373 0.680298 Ni\n0.031034 0.221434 0.436173 Ni\n0.031034 0.278566 0.936173 Ni\n0.512112 0.465627 0.180298 Ni\n0.487888 0.534373 0.680298 Ni\n0.968966 0.721434 0.436173 Ni\n0.968966 0.778566 0.936173 Ni\n0.487888 0.965627 0.180298 Ni\n0.306204 0.018709 0.308763 O\n0.844830 0.039735 0.208719 O\n0.310495 0.107198 0.096247 O\n0.855842 0.050587 0.411265 O\n0.093425 0.179117 0.812508 O\n0.653177 0.212437 0.670853 O\n0.325932 0.148026 0.524697 O\n0.736432 0.170081 0.990868 O\n0.325932 0.351974 0.024697 O\n0.736432 0.329919 0.490868 O\n0.653177 0.287563 0.170853 O\n0.093425 0.320883 0.312508 O\n0.310495 0.392802 0.596247 O\n0.855842 0.449413 0.911265 O\n0.306204 0.481291 0.808763 O\n0.844830 0.460265 0.708719 O\n0.155170 0.539735 0.208719 O\n0.693796 0.518709 0.308763 O\n0.144158 0.550587 0.411265 O\n0.689505 0.607198 0.096247 O\n0.346823 0.712437 0.670853 O\n0.906575 0.679117 0.812508 O\n0.263568 0.670081 0.990868 O\n0.674068 0.648026 0.524697 O\n0.674068 0.851974 0.024697 O\n0.263568 0.829919 0.490868 O\n0.346823 0.787563 0.170853 O\n0.906575 0.820883 0.312508 O\n0.144158 0.949413 0.911265 O\n0.689505 0.892802 0.596247 O\n0.155170 0.960265 0.708719 O\n0.693796 0.981291 0.808763 O\n",
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"volume": 676.982525380516,
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"formula_full": "Li16 Si8 Ni8 O32",
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{
"id": "mp-555842",
"created_at": "2022-09-04T14:45:25.166233Z",
"structure_string": "Na12 W4 O16 F4\n1.0\n5.714980 0.000000 0.000000\n0.000000 7.651415 0.000000\n0.000000 0.000000 13.083836\nNa W O F\n12 4 16 4\ndirect\n0.774724 0.458340 0.819783 Na\n0.225276 0.958340 0.180217 Na\n0.276404 0.750000 0.392306 Na\n0.725276 0.541660 0.319783 Na\n0.774724 0.041660 0.819783 Na\n0.776404 0.750000 0.107694 Na\n0.723596 0.250000 0.607694 Na\n0.274724 0.458340 0.680217 Na\n0.223596 0.250000 0.892306 Na\n0.725276 0.958340 0.319783 Na\n0.274724 0.041660 0.680217 Na\n0.225276 0.541660 0.180217 Na\n0.288399 0.750000 0.915708 W\n0.788399 0.750000 0.584292 W\n0.211601 0.250000 0.415708 W\n0.711601 0.250000 0.084292 W\n0.313677 0.443547 0.348766 O\n0.673586 0.750000 0.454965 O\n0.186323 0.556453 0.848766 O\n0.186323 0.943547 0.848766 O\n0.892457 0.250000 0.420627 O\n0.813677 0.056453 0.151234 O\n0.107543 0.750000 0.579373 O\n0.392457 0.250000 0.079373 O\n0.813677 0.443547 0.151234 O\n0.686323 0.943547 0.651234 O\n0.826414 0.250000 0.954965 O\n0.607543 0.750000 0.920627 O\n0.326414 0.250000 0.545035 O\n0.686323 0.556453 0.651234 O\n0.173586 0.750000 0.045035 O\n0.313677 0.056453 0.348766 O\n0.002540 0.250000 0.730410 F\n0.997460 0.750000 0.269590 F\n0.497460 0.750000 0.230410 F\n0.502540 0.250000 0.769590 F\n",
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{
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"structure_string": "La12 Au4 I12\n1.0\n-6.408154 6.408154 6.408154\n6.408154 -6.408154 6.408154\n6.408154 6.408154 -6.408154\nLa Au I\n12 4 12\ndirect\n0.471931 0.485966 0.235966 La\n0.750000 0.235966 0.264034 La\n0.750000 0.014034 0.485966 La\n0.235966 0.471931 0.485966 La\n0.264034 0.750000 0.235966 La\n0.028069 0.264034 0.014034 La\n0.014034 0.028069 0.264034 La\n0.485966 0.750000 0.014034 La\n0.485966 0.235966 0.471931 La\n0.014034 0.485966 0.750000 La\n0.264034 0.014034 0.028069 La\n0.235966 0.264034 0.750000 La\n0.250000 0.250000 0.250000 Au\n0.500000 0.000000 0.250000 Au\n0.000000 0.250000 0.500000 Au\n0.250000 0.500000 0.000000 Au\n0.250000 0.760228 0.739772 I\n0.520457 0.510228 0.760228 I\n0.979543 0.739772 0.989772 I\n0.739772 0.250000 0.760228 I\n0.989772 0.979543 0.739772 I\n0.250000 0.989772 0.510228 I\n0.760228 0.520457 0.510228 I\n0.510228 0.250000 0.989772 I\n0.760228 0.739772 0.250000 I\n0.739772 0.989772 0.979543 I\n0.989772 0.510228 0.250000 I\n0.510228 0.760228 0.520457 I\n",
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{
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"structure_string": "Ho2 P4 H10 O20\n1.0\n-6.423009 0.000000 0.000000\n-0.091468 -6.897068 0.000000\n1.799520 1.712174 9.990533\nHo P H O\n2 4 10 20\ndirect\n0.629609 0.742993 0.461761 Ho\n0.370391 0.257007 0.538239 Ho\n0.951676 0.867033 0.787367 P\n0.048324 0.132967 0.212633 P\n0.199039 0.767197 0.569563 P\n0.800961 0.232803 0.430437 P\n0.233934 0.547660 0.290388 H\n0.766066 0.452340 0.709612 H\n0.832663 0.771508 0.212387 H\n0.167337 0.228492 0.787613 H\n0.997837 0.813735 0.998451 H\n0.002163 0.186265 0.001549 H\n0.676079 0.586149 0.177883 H\n0.323921 0.413851 0.822117 H\n0.226455 0.753800 0.241620 H\n0.773545 0.246200 0.758380 H\n0.713171 0.708634 0.239376 O\n0.286829 0.291366 0.760624 O\n0.339799 0.585337 0.556712 O\n0.660201 0.414663 0.443288 O\n0.987167 0.747037 0.478381 O\n0.012833 0.252963 0.521619 O\n0.976349 0.741119 0.903188 O\n0.023651 0.258881 0.096812 O\n0.321192 0.659973 0.285525 O\n0.678808 0.340027 0.714475 O\n0.759715 0.791971 0.684596 O\n0.240285 0.208029 0.315404 O\n0.341272 0.935405 0.551094 O\n0.658728 0.064595 0.448906 O\n0.163188 0.808233 0.724025 O\n0.836812 0.191767 0.275975 O\n0.964401 0.087870 0.840929 O\n0.035599 0.912130 0.159071 O\n0.475601 0.086903 0.011525 O\n0.524399 0.913097 0.988475 O\n",
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{
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"structure_string": "Na4 U2 Mo6 O24\n1.0\n5.823501 3.741894 0.000000\n-5.823501 3.741894 0.000000\n0.000000 3.734068 11.207662\nNa U Mo O\n4 2 6 24\ndirect\n0.208687 0.459584 0.580142 Na\n0.540416 0.791313 0.919858 Na\n0.459584 0.208687 0.080142 Na\n0.791313 0.540416 0.419858 Na\n0.877362 0.122638 0.250000 U\n0.122638 0.877362 0.750000 U\n0.707230 0.957359 0.586320 Mo\n0.042641 0.292770 0.913680 Mo\n0.374456 0.625544 0.250000 Mo\n0.292770 0.042641 0.413680 Mo\n0.625544 0.374456 0.750000 Mo\n0.957359 0.707230 0.086320 Mo\n0.070951 0.503804 0.787183 O\n0.384737 0.811703 0.123611 O\n0.747332 0.143887 0.443978 O\n0.496196 0.929049 0.712817 O\n0.856113 0.252668 0.056022 O\n0.188297 0.615263 0.376389 O\n0.748532 0.649777 0.779626 O\n0.043331 0.973494 0.120602 O\n0.386402 0.306953 0.438116 O\n0.350223 0.251468 0.720374 O\n0.693047 0.613598 0.061884 O\n0.026506 0.956669 0.379398 O\n0.615263 0.188297 0.876389 O\n0.929049 0.496196 0.212817 O\n0.252668 0.856113 0.556022 O\n0.143887 0.747332 0.943978 O\n0.503804 0.070951 0.287183 O\n0.811703 0.384737 0.623611 O\n0.956669 0.026506 0.879398 O\n0.251468 0.350223 0.220374 O\n0.613598 0.693047 0.561884 O\n0.306953 0.386402 0.938116 O\n0.649777 0.748532 0.279626 O\n0.973494 0.043331 0.620602 O\n",
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{
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{
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}