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{
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"structure_string": "Ti2 P2 O8\n1.0\n4.866199 0.043288 0.000000\n-1.804030 4.519652 -0.000000\n-0.000000 0.000000 5.904595\nTi P O\n2 2 8\ndirect\n0.000000 0.000000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n0.648609 0.351391 0.250000 P\n0.351391 0.648609 0.750001 P\n0.243785 0.756215 0.536508 O\n0.756215 0.243786 0.036508 O\n0.756215 0.243786 0.463492 O\n0.243785 0.756215 0.963493 O\n0.698065 0.765800 0.750001 O\n0.301936 0.234200 0.250000 O\n0.765800 0.698065 0.250000 O\n0.234200 0.301936 0.750001 O\n",
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"structure_string": "V6 H4 O13\n1.0\n6.255685 -0.002457 -1.145456\n-5.084071 3.644972 1.145456\n0.015225 -0.004897 10.357160\nV H O\n6 4 13\ndirect\n0.644463 0.355536 -0.002130 V\n0.352527 0.647472 0.012369 V\n0.591530 0.408469 0.615465 V\n0.410771 0.589228 0.364832 V\n0.291820 0.708179 0.637014 V\n0.715188 0.284811 0.386493 V\n0.819649 0.180350 0.876849 H\n0.922460 0.077539 0.496268 H\n0.507432 0.492567 0.804666 H\n0.581144 0.418855 0.195122 H\n0.662852 0.337147 0.199828 O\n0.333721 0.666278 0.802739 O\n0.382357 0.617642 0.194343 O\n0.588655 0.411343 0.804413 O\n0.500887 0.499112 0.008123 O\n0.185958 0.814041 0.001190 O\n0.760227 0.239772 0.595986 O\n0.894115 0.105884 0.400126 O\n0.127058 0.872941 0.616437 O\n0.433559 0.566439 0.579223 O\n0.818790 0.181209 0.971882 O\n0.251250 0.748748 0.403695 O\n0.567674 0.432325 0.415312 O\n",
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{
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"structure_string": "Ba4 Mg1 Be1\n1.0\n-0.000000 5.102714 5.102714\n5.102714 0.000000 5.102714\n5.102714 5.102714 -0.000000\nBa Mg Be\n4 1 1\ndirect\n0.126499 0.624500 0.624500 Ba\n0.624500 0.624500 0.624500 Ba\n0.624500 0.126499 0.624500 Ba\n0.624500 0.624500 0.126499 Ba\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Be\n",
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{
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{
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"updated_at": "2022-09-04T14:37:12.538377Z",
"structure_string": "Li4 Mn6 O2 F12\n1.0\n5.881925 -0.134997 -0.091293\n0.735741 6.563528 -0.021536\n2.411063 2.670090 7.231839\nLi Mn O F\n4 6 2 12\ndirect\n0.290293 0.876816 0.484904 Li\n0.094575 0.314757 0.085222 Li\n0.905425 0.685243 0.914778 Li\n0.709707 0.123183 0.515096 Li\n0.744429 0.548872 0.655662 Mn\n0.897854 0.812437 0.225489 Mn\n0.379493 0.754760 0.937685 Mn\n0.620507 0.245240 0.062315 Mn\n0.102146 0.187563 0.774511 Mn\n0.255571 0.451128 0.344338 Mn\n0.091033 0.588741 0.133846 O\n0.908967 0.411258 0.866154 O\n0.579179 0.558169 0.129988 F\n0.080409 0.708766 0.448594 F\n0.420821 0.441830 0.870012 F\n0.583171 0.724037 0.443115 F\n0.767473 0.968304 0.989268 F\n0.172839 0.877753 0.732736 F\n0.317886 0.152363 0.282839 F\n0.682114 0.847637 0.717161 F\n0.827161 0.122247 0.267264 F\n0.232527 0.031696 0.010732 F\n0.416829 0.275963 0.556885 F\n0.919592 0.291234 0.551406 F\n",
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{
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"created_at": "2022-09-04T14:36:06.380757Z",
"updated_at": "2022-09-04T14:36:06.380783Z",
"structure_string": "Al12 N4 O12\n1.0\n5.661168 -0.000000 0.000000\n-0.000000 5.710546 0.000000\n0.000000 0.000000 8.065156\nAl N O\n12 4 12\ndirect\n0.750000 0.992543 0.117644 Al\n0.250000 0.507458 0.617644 Al\n0.750000 0.250036 0.742925 Al\n0.250000 0.007458 0.882357 Al\n0.500000 0.000000 0.500000 Al\n0.750000 0.750036 0.757075 Al\n0.250000 0.749965 0.257075 Al\n0.500000 0.500000 0.000000 Al\n0.000000 0.500000 0.000000 Al\n0.750000 0.492542 0.382356 Al\n0.250000 0.249964 0.242925 Al\n0.000000 0.000000 0.500000 Al\n0.250000 0.773509 0.491480 N\n0.250000 0.273508 0.008520 N\n0.750000 0.726492 0.991481 N\n0.750000 0.226492 0.508520 N\n0.513378 0.998140 0.746149 O\n0.750000 0.759291 0.512558 O\n0.250000 0.740710 0.012557 O\n0.513378 0.498139 0.753851 O\n0.486623 0.501861 0.246149 O\n0.013377 0.501861 0.246149 O\n0.750000 0.259291 0.987443 O\n0.250000 0.240709 0.487443 O\n0.013377 0.001861 0.253851 O\n0.486623 0.001861 0.253851 O\n0.986623 0.998140 0.746149 O\n0.986623 0.498139 0.753851 O\n",
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{
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"structure_string": "Ag2 P2 S6\n1.0\n5.831879 -0.039061 -3.138356\n-3.663942 5.492320 -0.521134\n0.087297 0.045181 6.654089\nAg P S\n2 2 6\ndirect\n0.721431 0.721431 0.000000 Ag\n0.278569 0.278569 0.000000 Ag\n0.063642 0.343810 0.407452 P\n0.936359 0.656190 0.592549 P\n0.649979 0.711401 0.361380 S\n0.350022 0.288599 0.638620 S\n0.772976 0.272976 0.500000 S\n0.227025 0.727024 0.500001 S\n0.130911 0.821227 0.952139 S\n0.869090 0.178773 0.047861 S\n",
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{
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"structure_string": "K4 Ni2 As4\n1.0\n5.740517 -0.000000 0.000000\n-0.000000 5.940497 -2.830164\n0.000000 0.007059 7.664432\nK Ni As\n4 2 4\ndirect\n0.750000 0.792799 0.585599 K\n0.250000 0.207202 0.414402 K\n0.750000 0.407866 0.815732 K\n0.250000 0.592134 0.184269 K\n0.000000 0.000000 0.000000 Ni\n0.500000 0.000000 0.000000 Ni\n0.750000 0.915566 0.206824 As\n0.250000 0.084435 0.793176 As\n0.250000 0.708744 0.793177 As\n0.750000 0.291257 0.206824 As\n",
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"structure_string": "Li4 V2 O4 F2\n1.0\n0.000000 5.093422 -0.045584\n2.879323 0.000000 0.000000\n0.000000 0.029730 -7.201421\nLi V O F\n4 2 4 2\ndirect\n0.581303 0.250000 0.838566 Li\n0.236464 0.250000 0.487451 Li\n0.418696 0.749999 0.161433 Li\n0.763535 0.749999 0.512548 Li\n0.063987 0.749999 0.832675 V\n0.936012 0.250000 0.167324 V\n0.241035 0.250000 0.992384 O\n0.758964 0.749999 0.007616 O\n0.076418 0.749999 0.323907 O\n0.923582 0.250000 0.676092 O\n0.410741 0.749999 0.665974 F\n0.589259 0.250000 0.334025 F\n",
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}