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{
"id": "mp-1218563",
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"structure_string": "Sr4 I1 Br1 N2\n1.0\n-1.998129 -3.460861 0.000000\n3.996258 0.000000 0.000000\n1.998129 -1.153620 15.214532\nSr I Br N\n4 1 1 2\ndirect\n0.615395 0.230789 0.153816 Sr\n0.109676 0.219352 0.670972 Sr\n0.890324 0.780648 0.329028 Sr\n0.384605 0.769211 0.846184 Sr\n0.500000 0.000000 0.500000 I\n0.000000 0.000000 0.000000 Br\n0.252936 0.505872 0.241192 N\n0.747064 0.494128 0.758808 N\n",
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{
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"structure_string": "Sr8 Mg1 P4 I4 O16\n1.0\n0.291405 0.095298 -9.187185\n-0.036613 -8.903601 0.107091\n-8.920355 -0.071779 4.044773\nSr Mg P I O\n8 1 4 4 16\ndirect\n0.963122 0.803348 0.844084 Sr\n0.473231 0.345860 0.294271 Sr\n0.039814 0.179488 0.114547 Sr\n0.461131 0.680662 0.877852 Sr\n0.483897 0.849614 0.241410 Sr\n0.042370 0.326361 0.746354 Sr\n0.513354 0.159888 0.759094 Sr\n0.963982 0.666488 0.224924 Sr\n0.701231 0.302004 0.142784 Mg\n0.231261 0.560587 0.040312 P\n0.267340 0.062509 0.962420 P\n0.770644 0.449399 0.921022 P\n0.738511 0.938227 0.027124 P\n0.220092 0.365109 0.480773 I\n0.274143 0.866341 0.489422 I\n0.793175 0.616880 0.499942 I\n0.713526 0.078630 0.539547 I\n0.171167 0.580310 0.864398 O\n0.337178 0.097705 0.137739 O\n0.876715 0.414711 0.096933 O\n0.622883 0.906219 0.858264 O\n0.783859 0.618677 0.895404 O\n0.732304 0.110645 0.049467 O\n0.198323 0.395675 0.073185 O\n0.312749 0.898493 0.948877 O\n0.318786 0.176245 0.870317 O\n0.147425 0.675388 0.097948 O\n0.688281 0.833883 0.128878 O\n0.825102 0.341544 0.831468 O\n0.919185 0.906427 0.067552 O\n0.591156 0.411464 0.890172 O\n0.077358 0.075247 0.895438 O\n0.418581 0.591686 0.123793 O\n",
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"formula_full": "Sr8 Mg1 P4 I4 O16",
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{
"id": "mp-1105845",
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"structure_string": "Lu4 Cu4 S8\n1.0\n3.932003 0.000000 0.000000\n0.000000 6.196226 0.000000\n0.000000 0.000000 13.182080\nLu Cu S\n4 4 8\ndirect\n0.282064 0.753806 0.634209 Lu\n0.782064 0.746194 0.365791 Lu\n0.717936 0.253806 0.865791 Lu\n0.217936 0.246194 0.134209 Lu\n0.706495 0.348237 0.556363 Cu\n0.206495 0.151763 0.443637 Cu\n0.293505 0.848237 0.943637 Cu\n0.793505 0.651763 0.056363 Cu\n0.778252 0.519029 0.707258 S\n0.278252 0.980971 0.292742 S\n0.221748 0.019029 0.792742 S\n0.721748 0.480971 0.207258 S\n0.784014 0.984338 0.539966 S\n0.284014 0.515662 0.460034 S\n0.215986 0.484338 0.960034 S\n0.715986 0.015662 0.039966 S\n",
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"formula_full": "Lu4 Cu4 S8",
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{
"id": "mp-1078999",
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"structure_string": "Nd1 Al1 H6\n1.0\n2.777450 -3.221371 0.000000\n2.777450 3.221371 0.000000\n-0.958793 0.000000 4.143933\nNd Al H\n1 1 6\ndirect\n0.500000 0.500000 0.500000 Nd\n0.000000 0.000000 0.000000 Al\n0.298060 0.938435 0.298060 H\n0.298060 0.298060 0.938435 H\n0.938435 0.298060 0.298060 H\n0.701940 0.061565 0.701940 H\n0.701940 0.701940 0.061565 H\n0.061565 0.701940 0.701940 H\n",
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{
"id": "mp-1204732",
"created_at": "2022-09-04T14:48:09.769738Z",
"structure_string": "Ge6 B2 H8 N2 O16\n1.0\n6.932345 0.036984 -1.648683\n-2.383571 6.994963 -1.659455\n0.080464 -0.059344 7.845957\nGe B H N O\n6 2 8 2 16\ndirect\n0.227308 0.216421 0.302575 Ge\n0.772692 0.783579 0.697425 Ge\n0.748832 0.154827 0.232973 Ge\n0.251168 0.845173 0.767027 Ge\n0.654137 0.333763 0.605851 Ge\n0.345863 0.666237 0.394149 Ge\n0.651477 0.105271 0.855957 B\n0.348523 0.894729 0.144043 B\n0.044530 0.277042 0.811423 H\n0.955470 0.722958 0.188577 H\n0.240327 0.484003 0.905152 H\n0.759673 0.515997 0.094848 H\n0.279347 0.268050 0.902992 H\n0.720653 0.731950 0.097008 H\n0.231575 0.323543 0.710206 H\n0.768425 0.676457 0.289794 H\n0.199047 0.339326 0.834262 N\n0.800953 0.660674 0.165738 N\n0.746339 0.192787 0.730198 O\n0.253661 0.807213 0.269802 O\n0.291543 0.068422 0.135236 O\n0.708457 0.931577 0.864764 O\n0.569973 0.937879 0.208033 O\n0.430027 0.062121 0.791967 O\n0.384519 0.276832 0.532444 O\n0.615481 0.723168 0.467556 O\n0.752207 0.570029 0.760507 O\n0.247793 0.429971 0.239493 O\n0.733446 0.245912 0.044415 O\n0.266554 0.754088 0.955585 O\n0.749294 0.344358 0.417519 O\n0.250706 0.655642 0.582481 O\n0.981636 0.110085 0.311090 O\n0.018364 0.889915 0.688910 O\n",
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"formula_full": "Ge6 B2 H8 N2 O16",
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{
"id": "mp-1173619",
"created_at": "2022-09-04T14:48:14.873760Z",
"structure_string": "Nb12 Al12 O48\n1.0\n3.808214 -0.321569 0.021724\n-1.387236 5.974566 -1.861657\n0.017219 0.309766 39.294825\nNb Al O\n12 12 48\ndirect\n0.103042 0.209857 0.289059 Nb\n0.099316 0.208314 0.456307 Nb\n0.099279 0.208162 0.622923 Nb\n0.099196 0.208271 0.789602 Nb\n0.098573 0.208233 0.955730 Nb\n0.194744 0.392412 0.211871 Nb\n0.805256 0.607588 0.121463 Nb\n0.901427 0.791767 0.377604 Nb\n0.900721 0.791838 0.710410 Nb\n0.896958 0.790143 0.044274 Nb\n0.900804 0.791729 0.543731 Nb\n0.900684 0.791686 0.877027 Nb\n0.096929 0.191920 0.114338 Al\n0.205803 0.402841 0.052399 Al\n0.206621 0.404360 0.386917 Al\n0.207361 0.406948 0.554037 Al\n0.207549 0.407684 0.887386 Al\n0.207210 0.406887 0.720673 Al\n0.792639 0.593052 0.779296 Al\n0.792790 0.593113 0.612661 Al\n0.792451 0.592316 0.445947 Al\n0.794197 0.597159 0.280934 Al\n0.793379 0.595640 0.946416 Al\n0.903071 0.808080 0.218995 Al\n0.064862 0.120663 0.062304 O\n0.059883 0.117946 0.227147 O\n0.065091 0.115577 0.560008 O\n0.065142 0.115220 0.393571 O\n0.064983 0.115631 0.726683 O\n0.065143 0.116270 0.893340 O\n0.137998 0.279330 0.003965 O\n0.138388 0.278087 0.163749 O\n0.141634 0.284866 0.504717 O\n0.141035 0.278631 0.337602 O\n0.141530 0.284718 0.671342 O\n0.141652 0.285172 0.838021 O\n0.261671 0.519939 0.107021 O\n0.261932 0.529045 0.276067 O\n0.260124 0.523844 0.440054 O\n0.260337 0.524666 0.606726 O\n0.260214 0.524702 0.773388 O\n0.260501 0.526370 0.940157 O\n0.359735 0.715839 0.049605 O\n0.360978 0.714128 0.382661 O\n0.366332 0.735275 0.217847 O\n0.361596 0.716551 0.549362 O\n0.361674 0.717092 0.882642 O\n0.361463 0.716567 0.716027 O\n0.638326 0.282908 0.450691 O\n0.633668 0.264725 0.115487 O\n0.638404 0.283449 0.783971 O\n0.640265 0.284160 0.283728 O\n0.638537 0.283433 0.617307 O\n0.639022 0.285872 0.950672 O\n0.738068 0.470954 0.057267 O\n0.739499 0.473630 0.393176 O\n0.738329 0.480061 0.226312 O\n0.739663 0.475334 0.726607 O\n0.739786 0.475298 0.559946 O\n0.739876 0.476156 0.893279 O\n0.862002 0.720670 0.329369 O\n0.861612 0.721913 0.169584 O\n0.858366 0.715134 0.828617 O\n0.858470 0.715282 0.661991 O\n0.858348 0.714828 0.495312 O\n0.858965 0.721369 0.995731 O\n0.934857 0.883730 0.439993 O\n0.940117 0.882054 0.106186 O\n0.934909 0.884423 0.773326 O\n0.935138 0.879337 0.271030 O\n0.935017 0.884369 0.606650 O\n0.934858 0.884780 0.939762 O\n",
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{
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"structure_string": "K2 Tl2 C8 N8\n1.0\n-3.895930 3.895930 7.718885\n3.895930 -3.895930 7.718885\n3.895930 3.895930 -7.718885\nK Tl C N\n2 2 8 8\ndirect\n0.250000 0.750000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 Tl\n0.750000 0.250000 0.500000 Tl\n0.099980 0.045420 0.316261 C\n0.533720 0.349980 0.554560 C\n0.795420 0.979159 0.445440 C\n0.729159 0.783720 0.683739 C\n0.954580 0.270841 0.054560 C\n0.020841 0.466280 0.816261 C\n0.650020 0.204580 0.183739 C\n0.216280 0.900020 0.945440 C\n0.584210 0.672034 0.523687 N\n0.810522 0.834210 0.412176 N\n0.422034 0.398347 0.587824 N\n0.148347 0.060522 0.476313 N\n0.939478 0.415790 0.087824 N\n0.165790 0.577966 0.976313 N\n0.601653 0.189478 0.023687 N\n0.327966 0.851653 0.912176 N\n",
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{
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"structure_string": "Li4 Co4 P8 O28\n1.0\n5.963082 -0.056744 -1.823905\n0.551461 9.372884 4.340474\n0.057354 0.074105 9.050406\nLi Co P O\n4 4 8 28\ndirect\n0.535150 0.018295 0.497748 Li\n0.358000 0.617835 0.925092 Li\n0.025042 0.511498 0.173613 Li\n0.934566 0.472651 0.844150 Li\n0.709627 0.777700 0.099608 Co\n0.626819 0.753900 0.480864 Co\n0.292826 0.226294 0.896215 Co\n0.373015 0.253541 0.510354 Co\n0.299376 0.964088 0.807776 P\n0.415736 0.466577 0.691745 P\n0.704105 0.043496 0.181745 P\n0.892842 0.297729 0.561347 P\n0.103862 0.211843 0.185809 P\n0.906333 0.792582 0.806157 P\n0.107048 0.707597 0.429864 P\n0.578893 0.540292 0.301781 P\n0.635726 0.573220 0.133052 O\n0.316515 0.188753 0.336585 O\n0.622975 0.552682 0.662391 O\n0.560627 0.695804 0.289285 O\n0.313715 0.794538 0.452674 O\n0.055014 0.281474 0.470778 O\n0.437574 0.311743 0.703883 O\n0.154692 0.153041 0.070475 O\n0.944594 0.729218 0.516548 O\n0.028835 0.645626 0.890291 O\n0.372485 0.454368 0.330076 O\n0.996518 0.291871 0.738843 O\n0.934375 0.096240 0.272131 O\n0.065868 0.914646 0.716367 O\n0.352903 0.440556 0.854873 O\n0.688853 0.813563 0.660187 O\n0.206919 0.541847 0.533943 O\n0.607549 0.953564 0.332083 O\n0.000334 0.708687 0.254030 O\n0.751938 0.962325 0.087973 O\n0.429235 0.818522 0.926118 O\n0.999341 0.362452 0.094650 O\n0.686625 0.210063 0.537162 O\n0.572496 0.185968 0.059153 O\n0.789681 0.463439 0.455456 O\n0.856154 0.841805 0.929028 O\n0.256903 0.040590 0.907091 O\n0.398685 0.054342 0.660646 O\n",
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{
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