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{
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{
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{
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"structure_string": "Na8 Ni4 P4 C4 O28\n1.0\n5.175867 0.000000 0.000000\n0.225515 10.983887 0.000000\n0.198484 3.162237 10.641361\nNa Ni P C O\n8 4 4 4 28\ndirect\n0.249951 0.899464 0.872300 Na\n0.750049 0.100536 0.127700 Na\n0.754157 0.379541 0.864440 Na\n0.219969 0.063519 0.348699 Na\n0.780031 0.936481 0.651301 Na\n0.247761 0.384425 0.376600 Na\n0.245843 0.620459 0.135560 Na\n0.752239 0.615575 0.623400 Na\n0.778010 0.796684 0.047169 Ni\n0.221990 0.203316 0.952831 Ni\n0.782162 0.294995 0.550139 Ni\n0.217838 0.705005 0.449861 Ni\n0.716684 0.088090 0.836386 P\n0.283316 0.911910 0.163614 P\n0.724421 0.585688 0.335325 P\n0.275579 0.414312 0.664675 P\n0.285485 0.835046 0.596111 C\n0.286587 0.338759 0.088641 C\n0.713413 0.661241 0.911359 C\n0.714515 0.164954 0.403889 C\n0.783972 0.943384 0.874771 O\n0.133710 0.839763 0.086325 O\n0.423509 0.103885 0.866045 O\n0.576491 0.896115 0.133955 O\n0.866290 0.160237 0.913675 O\n0.201683 0.369964 0.805337 O\n0.226207 0.866536 0.305462 O\n0.216028 0.056616 0.125229 O\n0.478403 0.289758 0.037953 O\n0.473511 0.787202 0.542964 O\n0.054266 0.814037 0.563537 O\n0.061045 0.307392 0.056496 O\n0.671538 0.098269 0.330571 O\n0.684978 0.594327 0.838974 O\n0.328462 0.901731 0.669429 O\n0.315022 0.405673 0.161026 O\n0.938955 0.692608 0.943504 O\n0.945734 0.185963 0.436463 O\n0.526489 0.212798 0.457036 O\n0.521597 0.710242 0.962047 O\n0.773793 0.133464 0.694538 O\n0.798317 0.630036 0.194663 O\n0.795369 0.442047 0.381980 O\n0.135467 0.339347 0.587436 O\n0.427096 0.603169 0.353289 O\n0.572904 0.396831 0.646711 O\n0.864533 0.660653 0.412564 O\n0.204631 0.557953 0.618020 O\n",
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{
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"structure_string": "Th4 S8 O64\n1.0\n12.472280 0.000000 0.000000\n0.000000 7.855319 0.000000\n0.000000 5.572143 14.194837\nTh S O\n4 8 64\ndirect\n0.621445 0.806489 0.714299 Th\n0.878555 0.806489 0.214299 Th\n0.378555 0.193511 0.285701 Th\n0.121445 0.193511 0.785701 Th\n0.716186 0.747955 0.547546 S\n0.783814 0.747955 0.047546 S\n0.283814 0.252045 0.452454 S\n0.216186 0.252045 0.952454 S\n0.604293 0.143990 0.760625 S\n0.895707 0.143990 0.260625 S\n0.395707 0.856010 0.239375 S\n0.104293 0.856010 0.739375 S\n0.891016 0.254178 0.517680 O\n0.608984 0.254178 0.017680 O\n0.108984 0.745822 0.482320 O\n0.391016 0.745822 0.982320 O\n0.906245 0.279381 0.937868 O\n0.593755 0.279381 0.437868 O\n0.093755 0.720619 0.062132 O\n0.406245 0.720619 0.562132 O\n0.635618 0.629540 0.625381 O\n0.864382 0.629540 0.125381 O\n0.364382 0.370460 0.374619 O\n0.135618 0.370460 0.874619 O\n0.447229 0.561625 0.814821 O\n0.052771 0.561625 0.314821 O\n0.552771 0.438375 0.185179 O\n0.947229 0.438375 0.685179 O\n0.809898 0.643123 0.544892 O\n0.690102 0.643123 0.044892 O\n0.190102 0.356877 0.455108 O\n0.309898 0.356877 0.955108 O\n0.741614 0.892223 0.593802 O\n0.758386 0.892223 0.093802 O\n0.258386 0.107777 0.406198 O\n0.241614 0.107777 0.906198 O\n0.607469 0.112008 0.664032 O\n0.892531 0.112008 0.164032 O\n0.392531 0.887992 0.335968 O\n0.107469 0.887992 0.835968 O\n0.417975 0.713641 0.814905 O\n0.082025 0.713641 0.314905 O\n0.582025 0.286359 0.185095 O\n0.917975 0.286359 0.685095 O\n0.506366 0.236059 0.767278 O\n0.993634 0.236059 0.267278 O\n0.493634 0.763941 0.232722 O\n0.006366 0.763941 0.732722 O\n0.703891 0.224290 0.774403 O\n0.796109 0.224290 0.274403 O\n0.296109 0.775710 0.225597 O\n0.203891 0.775710 0.725597 O\n0.806034 0.719024 0.816549 O\n0.693966 0.719024 0.316549 O\n0.193966 0.280976 0.183451 O\n0.306034 0.280976 0.683451 O\n0.770307 0.559421 0.839669 O\n0.729693 0.559421 0.339669 O\n0.229693 0.440579 0.160331 O\n0.270307 0.440579 0.660331 O\n0.600967 0.936494 0.826255 O\n0.899033 0.936494 0.326255 O\n0.399033 0.063506 0.173745 O\n0.100967 0.063506 0.673745 O\n0.431139 0.812137 0.609559 O\n0.068861 0.812137 0.109559 O\n0.568861 0.187863 0.390441 O\n0.931139 0.187863 0.890441 O\n0.595528 0.405010 0.956254 O\n0.904472 0.405010 0.456254 O\n0.404472 0.594990 0.043746 O\n0.095528 0.594990 0.543746 O\n0.658853 0.836590 0.460093 O\n0.841147 0.836590 0.960093 O\n0.341147 0.163410 0.539907 O\n0.158853 0.163410 0.039907 O\n",
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{
"id": "mp-1205724",
"created_at": "2022-09-04T14:39:33.571698Z",
"structure_string": "Pr4 Cd2 Rh4\n1.0\n7.585268 0.000000 0.000000\n0.000000 7.585268 0.000000\n0.000000 0.000000 4.048807\nPr Cd Rh\n4 2 4\ndirect\n0.673456 0.173456 0.500000 Pr\n0.326544 0.826544 0.500000 Pr\n0.173456 0.326544 0.500000 Pr\n0.826544 0.673456 0.500000 Pr\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.000000 Cd\n0.127644 0.627644 0.000000 Rh\n0.872356 0.372356 0.000000 Rh\n0.627644 0.872356 0.000000 Rh\n0.372356 0.127644 0.000000 Rh\n",
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{
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"created_at": "2022-09-04T14:39:25.958401Z",
"structure_string": "Zr8 Ti2 Pb10 O30\n1.0\n5.883601 -0.000726 0.000518\n-2.941582 1.701262 4.885221\n0.003359 -23.787010 4.876481\nZr Ti Pb O\n8 2 10 30\ndirect\n0.120317 0.240242 0.299889 Zr\n0.520238 0.040431 0.502078 Zr\n0.920852 0.841186 0.703646 Zr\n0.323093 0.645663 0.905884 Zr\n0.722014 0.444148 0.103050 Zr\n0.820170 0.639571 0.401110 Zr\n0.220332 0.440562 0.602904 Zr\n0.620395 0.241422 0.804490 Zr\n0.023655 0.048540 0.004467 Ti\n0.424614 0.847482 0.202303 Ti\n0.105461 0.211106 0.156126 Pb\n0.501537 0.000518 0.354970 Pb\n0.901584 0.803036 0.557423 Pb\n0.302183 0.604246 0.758711 Pb\n0.705657 0.413952 0.959834 Pb\n0.200954 0.402679 0.456909 Pb\n0.601671 0.203288 0.657944 Pb\n0.002942 0.003180 0.861592 Pb\n0.400926 0.801588 0.057308 Pb\n0.799206 0.600095 0.252943 Pb\n0.280994 0.506111 0.244734 O\n0.683700 0.298210 0.445162 O\n0.084576 0.097913 0.646469 O\n0.481047 0.896534 0.848181 O\n0.878518 0.702847 0.047299 O\n0.435976 0.384233 0.355565 O\n0.837328 0.185874 0.558049 O\n0.239253 0.986363 0.759024 O\n0.649834 0.795210 0.959562 O\n0.045082 0.591504 0.156833 O\n0.921561 0.396784 0.342561 O\n0.320002 0.200338 0.543829 O\n0.719469 0.000961 0.745108 O\n0.123425 0.806552 0.948259 O\n0.524531 0.601899 0.146122 O\n0.754477 0.991381 0.241617 O\n0.178864 0.799442 0.443261 O\n0.580966 0.600764 0.644375 O\n0.978666 0.399944 0.847667 O\n0.354216 0.190761 0.044893 O\n0.257155 0.981891 0.252002 O\n0.648784 0.785555 0.457083 O\n0.048227 0.586184 0.658610 O\n0.445352 0.386393 0.859957 O\n0.854589 0.181690 0.054320 O\n0.917583 0.896851 0.343550 O\n0.313484 0.697887 0.545871 O\n0.714030 0.497843 0.747298 O\n0.117580 0.286533 0.952192 O\n0.518752 0.084256 0.149225 O\n",
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{
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"structure_string": "Ni10 P16 O56\n1.0\n9.254258 0.000000 0.000000\n4.610105 9.681583 0.000000\n3.529964 0.750831 12.231989\nNi P O\n10 16 56\ndirect\n0.749377 0.753401 0.936357 Ni\n0.250623 0.246599 0.063643 Ni\n0.208239 0.990269 0.739604 Ni\n0.385678 0.717153 0.388415 Ni\n0.737800 0.757048 0.435660 Ni\n0.791761 0.009731 0.260396 Ni\n0.608777 0.281600 0.107745 Ni\n0.391223 0.718400 0.892255 Ni\n0.262200 0.242952 0.564340 Ni\n0.614322 0.282847 0.611585 Ni\n0.128460 0.715003 0.789989 P\n0.344907 0.955974 0.958572 P\n0.340147 0.950139 0.463120 P\n0.729026 0.460470 0.396639 P\n0.871540 0.284997 0.210011 P\n0.745327 0.459242 0.895831 P\n0.254673 0.540758 0.104169 P\n0.092096 0.717948 0.289714 P\n0.659853 0.049861 0.536880 P\n0.632862 0.807192 0.690055 P\n0.907904 0.282052 0.710286 P\n0.270974 0.539530 0.603361 P\n0.655093 0.044026 0.041428 P\n0.643586 0.813050 0.192669 P\n0.356414 0.186950 0.807331 P\n0.367138 0.192808 0.309945 P\n0.435874 0.030873 0.859230 O\n0.733445 0.827896 0.273316 O\n0.482730 0.807478 0.969254 O\n0.584642 0.544701 0.858383 O\n0.013848 0.269741 0.112711 O\n0.564126 0.969127 0.140770 O\n0.740092 0.334666 0.475166 O\n0.282114 0.038918 0.057633 O\n0.266981 0.667928 0.035019 O\n0.778431 0.071032 0.087226 O\n0.986152 0.730259 0.887289 O\n0.542188 0.187956 0.260778 O\n0.784164 0.559206 0.427667 O\n0.133712 0.609675 0.711707 O\n0.410041 0.036271 0.363318 O\n0.979687 0.701902 0.398798 O\n0.500851 0.225286 0.753131 O\n0.717886 0.961082 0.942367 O\n0.215836 0.440794 0.572333 O\n0.795292 0.548554 0.946235 O\n0.119802 0.851521 0.726952 O\n0.293184 0.637723 0.824645 O\n0.510974 0.192442 0.530312 O\n0.278043 0.032730 0.564653 O\n0.735595 0.775696 0.773347 O\n0.415358 0.455299 0.141617 O\n0.457812 0.812044 0.739222 O\n0.204708 0.451446 0.053765 O\n0.265936 0.674869 0.302855 O\n0.220542 0.910666 0.427766 O\n0.731923 0.711873 0.596061 O\n0.779458 0.089334 0.572234 O\n0.978140 0.138509 0.766964 O\n0.112048 0.603224 0.211648 O\n0.866288 0.390325 0.288293 O\n0.734064 0.325131 0.697145 O\n0.441938 0.471384 0.629457 O\n0.020313 0.298098 0.601202 O\n0.733019 0.332072 0.964981 O\n0.887952 0.396776 0.788352 O\n0.758493 0.722025 0.099369 O\n0.268077 0.288127 0.403939 O\n0.880198 0.148479 0.273048 O\n0.489026 0.807558 0.469688 O\n0.589959 0.963729 0.636682 O\n0.264405 0.224304 0.226653 O\n0.558062 0.528616 0.370543 O\n0.706816 0.362277 0.175355 O\n0.266555 0.172104 0.726684 O\n0.241507 0.277975 0.900631 O\n0.499149 0.774714 0.246869 O\n0.221569 0.928968 0.912774 O\n0.259908 0.665334 0.524834 O\n0.721957 0.967270 0.435347 O\n0.021860 0.861491 0.233036 O\n0.517270 0.192522 0.030746 O\n",
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{
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"structure_string": "Li16 Mn8 F32\n1.0\n8.725112 0.000000 0.000000\n0.000000 7.239479 0.000000\n0.000000 0.602938 10.586616\nLi Mn F\n16 8 32\ndirect\n0.555673 0.824465 0.642615 Li\n0.060066 0.745786 0.867988 Li\n0.944327 0.824465 0.142615 Li\n0.439934 0.745786 0.367988 Li\n0.412635 0.710177 0.889170 Li\n0.887537 0.728800 0.625233 Li\n0.087365 0.710177 0.389170 Li\n0.612463 0.728800 0.125233 Li\n0.387537 0.271200 0.874767 Li\n0.912635 0.289823 0.610830 Li\n0.112463 0.271200 0.374767 Li\n0.587365 0.289823 0.110830 Li\n0.560066 0.254214 0.632012 Li\n0.055673 0.175535 0.857385 Li\n0.939934 0.254214 0.132012 Li\n0.444327 0.175535 0.357385 Li\n0.232005 0.995725 0.624503 Mn\n0.267995 0.995725 0.124503 Mn\n0.241847 0.539053 0.634488 Mn\n0.741847 0.460947 0.865512 Mn\n0.258153 0.539053 0.134488 Mn\n0.758153 0.460947 0.365512 Mn\n0.732005 0.004275 0.875497 Mn\n0.767995 0.004275 0.375497 Mn\n0.951765 0.959029 0.808676 F\n0.548235 0.959029 0.308676 F\n0.733867 0.888856 0.557085 F\n0.766133 0.888856 0.057085 F\n0.244553 0.753115 0.769311 F\n0.077406 0.806509 0.554687 F\n0.623205 0.746717 0.813867 F\n0.255447 0.753115 0.269311 F\n0.422594 0.806509 0.054687 F\n0.400841 0.731568 0.541609 F\n0.876795 0.746717 0.313867 F\n0.099159 0.731568 0.041609 F\n0.933712 0.583144 0.780809 F\n0.566288 0.583144 0.280809 F\n0.334405 0.482361 0.959992 F\n0.834405 0.517639 0.540008 F\n0.165595 0.482361 0.459992 F\n0.665595 0.517639 0.040008 F\n0.433712 0.416856 0.719191 F\n0.066288 0.416856 0.219191 F\n0.900841 0.268432 0.958391 F\n0.123205 0.253283 0.686133 F\n0.599159 0.268432 0.458391 F\n0.577406 0.193491 0.945313 F\n0.744553 0.246885 0.730689 F\n0.376795 0.253283 0.186133 F\n0.922594 0.193491 0.445313 F\n0.755447 0.246885 0.230689 F\n0.233867 0.111144 0.942915 F\n0.266133 0.111144 0.442915 F\n0.451765 0.040971 0.691324 F\n0.048235 0.040971 0.191324 F\n",
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