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{
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{
"id": "mp-565354",
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"structure_string": "La2 P10 Cl36 O34\n1.0\n18.006344 0.000000 0.000000\n0.000000 10.419957 0.000000\n0.000000 0.014465 10.607721\nLa P Cl O\n2 10 36 34\ndirect\n0.248219 0.219366 0.289721 La\n0.748219 0.780634 0.710279 La\n0.201603 0.884006 0.455891 P\n0.903023 0.604992 0.909573 P\n0.229125 0.999117 0.983317 P\n0.403023 0.395008 0.090427 P\n0.521436 0.830123 0.730779 P\n0.729125 0.000883 0.016683 P\n0.640519 0.629308 0.408529 P\n0.021436 0.169877 0.269221 P\n0.701603 0.115994 0.544109 P\n0.140519 0.370692 0.591471 P\n0.989231 0.163719 0.090101 Cl\n0.570646 0.756742 0.333284 Cl\n0.285023 0.096500 0.852640 Cl\n0.966181 0.318833 0.341766 Cl\n0.114447 0.875402 0.570813 Cl\n0.070646 0.243258 0.666716 Cl\n0.614447 0.124598 0.429187 Cl\n0.172317 0.447955 0.117902 Cl\n0.466181 0.681167 0.658234 Cl\n0.406765 0.409344 0.903319 Cl\n0.198882 0.438460 0.736177 Cl\n0.502247 0.327633 0.141242 Cl\n0.266986 0.819807 0.975296 Cl\n0.576891 0.482380 0.462269 Cl\n0.400135 0.574427 0.154846 Cl\n0.906765 0.590656 0.096681 Cl\n0.910968 0.012637 0.769783 Cl\n0.698882 0.561540 0.263823 Cl\n0.076891 0.517620 0.537731 Cl\n0.766986 0.180193 0.024704 Cl\n0.475774 0.984784 0.651355 Cl\n0.410968 0.987363 0.230217 Cl\n0.900135 0.425573 0.845154 Cl\n0.678838 0.235905 0.684503 Cl\n0.625903 0.013329 0.084739 Cl\n0.785023 0.903500 0.147360 Cl\n0.377468 0.312606 0.528739 Cl\n0.672317 0.552045 0.882098 Cl\n0.877468 0.687394 0.471261 Cl\n0.784523 0.198714 0.449474 Cl\n0.489231 0.836281 0.909899 Cl\n0.178838 0.764095 0.315497 Cl\n0.284523 0.801286 0.550526 Cl\n0.125903 0.986671 0.915261 Cl\n0.002247 0.672367 0.858758 Cl\n0.975774 0.015216 0.348645 Cl\n0.340322 0.314290 0.133650 O\n0.718002 0.983412 0.585782 O\n0.214927 0.529606 0.034929 O\n0.385680 0.858568 0.260163 O\n0.369704 0.421216 0.613197 O\n0.840322 0.685710 0.866350 O\n0.602788 0.823376 0.712494 O\n0.102788 0.176624 0.287506 O\n0.846603 0.648853 0.597815 O\n0.703763 0.546393 0.751486 O\n0.685912 0.684543 0.511205 O\n0.218002 0.016588 0.414218 O\n0.595225 0.515151 0.879844 O\n0.346603 0.351147 0.402185 O\n0.869704 0.578784 0.386803 O\n0.954923 0.721452 0.486659 O\n0.714927 0.470394 0.965071 O\n0.906665 0.988132 0.904442 O\n0.834274 0.797141 0.427344 O\n0.885680 0.141432 0.739837 O\n0.203763 0.453607 0.248514 O\n0.334274 0.202859 0.572656 O\n0.680273 0.688659 0.919546 O\n0.454923 0.278548 0.513341 O\n0.862009 0.919140 0.702742 O\n0.231851 0.054649 0.111722 O\n0.095225 0.484849 0.120156 O\n0.406665 0.011868 0.095558 O\n0.362009 0.080860 0.297258 O\n0.180273 0.311341 0.080454 O\n0.731851 0.945351 0.888278 O\n0.986431 0.993151 0.724848 O\n0.486431 0.006849 0.275152 O\n0.185912 0.315457 0.488795 O\n",
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"elements": [
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{
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"created_at": "2022-09-04T14:43:43.695006Z",
"structure_string": "K8 Cu2 P12 H16 O44\n1.0\n14.500870 0.000000 0.000000\n0.000000 8.575237 0.000000\n0.000000 0.998336 8.560211\nK Cu P H O\n8 2 12 16 44\ndirect\n0.096765 0.053596 0.175005 K\n0.596765 0.946404 0.324995 K\n0.903235 0.946404 0.824995 K\n0.403235 0.053596 0.675005 K\n0.281734 0.667222 0.002695 K\n0.781734 0.332778 0.497305 K\n0.718266 0.332778 0.997305 K\n0.218266 0.667222 0.502695 K\n0.500000 0.500000 0.500000 Cu\n0.000000 0.500000 0.000000 Cu\n0.334790 0.998458 0.257435 P\n0.834790 0.001542 0.242565 P\n0.665210 0.001542 0.742565 P\n0.165210 0.998458 0.757435 P\n0.325847 0.328189 0.309359 P\n0.825847 0.671811 0.190641 P\n0.674153 0.671811 0.690641 P\n0.174153 0.328189 0.809359 P\n0.450055 0.233615 0.066751 P\n0.950055 0.766385 0.433249 P\n0.549945 0.766385 0.933249 P\n0.049945 0.233615 0.566751 P\n0.070554 0.650883 0.215646 H\n0.570554 0.349117 0.284354 H\n0.929446 0.349117 0.784354 H\n0.429446 0.650883 0.715646 H\n0.135562 0.500547 0.199893 H\n0.635562 0.499453 0.300107 H\n0.864438 0.499453 0.800107 H\n0.364438 0.500547 0.699893 H\n0.422708 0.740288 0.363159 H\n0.922708 0.259712 0.136841 H\n0.577292 0.259712 0.636841 H\n0.077292 0.740288 0.863159 H\n0.483092 0.665617 0.232508 H\n0.983092 0.334383 0.267492 H\n0.516908 0.334383 0.767492 H\n0.016908 0.665617 0.732508 H\n0.263658 0.888683 0.206430 O\n0.763658 0.111317 0.293570 O\n0.736342 0.111317 0.793570 O\n0.236342 0.888683 0.706430 O\n0.399334 0.937351 0.387961 O\n0.899334 0.062649 0.112039 O\n0.600666 0.062649 0.612039 O\n0.100666 0.937351 0.887961 O\n0.279742 0.155167 0.295666 O\n0.779742 0.844833 0.204334 O\n0.720258 0.844833 0.704334 O\n0.220258 0.155167 0.795666 O\n0.391354 0.309734 0.445080 O\n0.891354 0.690266 0.054920 O\n0.608646 0.690266 0.554920 O\n0.108646 0.309734 0.945080 O\n0.250583 0.447807 0.296616 O\n0.750583 0.552193 0.203384 O\n0.749417 0.552193 0.703384 O\n0.249417 0.447807 0.796616 O\n0.446213 0.270914 0.892721 O\n0.946213 0.729086 0.607279 O\n0.553787 0.729086 0.107279 O\n0.053787 0.270914 0.392721 O\n0.542712 0.228999 0.146635 O\n0.042712 0.771001 0.353365 O\n0.457288 0.771001 0.853365 O\n0.957288 0.228999 0.646635 O\n0.382354 0.355064 0.142846 O\n0.882354 0.644936 0.357154 O\n0.617646 0.644936 0.857154 O\n0.117646 0.355064 0.642846 O\n0.396221 0.067126 0.105903 O\n0.896221 0.932874 0.394097 O\n0.603779 0.932874 0.894097 O\n0.103779 0.067126 0.605903 O\n0.096836 0.582111 0.139823 O\n0.596836 0.417889 0.360177 O\n0.903164 0.417889 0.860177 O\n0.403164 0.582111 0.639823 O\n0.440461 0.638303 0.325792 O\n0.940461 0.361697 0.174208 O\n0.559539 0.361697 0.674208 O\n0.059539 0.638303 0.825792 O\n",
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{
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"structure_string": "Ca12 Al12 Si6 H4 O48\n1.0\n7.680007 0.000000 0.000000\n-2.664276 7.412403 0.000000\n-2.434598 -3.647154 18.766301\nCa Al Si H O\n12 12 6 4 48\ndirect\n0.894983 0.900796 0.099231 Ca\n0.958382 0.654898 0.332097 Ca\n0.479217 0.465855 0.238348 Ca\n0.627171 0.322579 0.664155 Ca\n0.242948 0.230682 0.765556 Ca\n0.575696 0.567890 0.433300 Ca\n0.135430 0.127335 0.570338 Ca\n0.668749 0.979007 0.331542 Ca\n0.799974 0.796687 0.902989 Ca\n0.332840 0.642179 0.664103 Ca\n0.992976 0.286887 0.000190 Ca\n0.297803 0.006088 0.002662 Ca\n0.418349 0.673167 0.082541 Al\n0.665401 0.420349 0.086665 Al\n0.006902 0.252779 0.246686 Al\n0.744824 0.257178 0.500489 Al\n0.583449 0.084565 0.166277 Al\n0.251566 0.000575 0.250070 Al\n0.674842 0.923304 0.582821 Al\n0.410479 0.918120 0.833392 Al\n0.918328 0.673278 0.583222 Al\n0.257921 0.746611 0.499354 Al\n0.922232 0.415166 0.833585 Al\n0.580262 0.332396 0.918534 Al\n0.086060 0.585403 0.167192 Si\n0.080749 0.329397 0.416272 Si\n0.321950 0.077596 0.416256 Si\n0.749412 0.995012 0.750758 Si\n0.335179 0.583139 0.915814 Si\n0.990218 0.743959 0.749054 Si\n0.230336 0.230493 0.114610 H\n0.660418 0.307320 0.330309 H\n0.328293 0.974498 0.664002 H\n0.990378 0.654265 0.995985 H\n0.916795 0.476520 0.097946 O\n0.283357 0.573584 0.146399 O\n0.484698 0.687872 0.335784 O\n0.393267 0.408350 0.603764 O\n0.144500 0.554022 0.426876 O\n0.627654 0.629534 0.094914 O\n0.046192 0.485286 0.236911 O\n0.757300 0.484260 0.521357 O\n0.551703 0.141546 0.426723 O\n0.958793 0.240967 0.335765 O\n0.673733 0.435226 0.336965 O\n0.817249 0.093940 0.185964 O\n0.957833 0.244297 0.475166 O\n0.143558 0.145161 0.073976 O\n0.147600 0.351841 0.667837 O\n0.066205 0.068270 0.923643 O\n0.571538 0.297305 0.151056 O\n0.818322 0.220359 0.761271 O\n0.274443 0.273141 0.427264 O\n0.710668 0.151492 0.574430 O\n0.209539 0.202496 0.239557 O\n0.484558 0.039288 0.243107 O\n0.623071 0.902293 0.670966 O\n0.219867 0.805032 0.758607 O\n0.338198 0.100977 0.667533 O\n0.218960 0.953833 0.337381 O\n0.490242 0.761867 0.519133 O\n0.625813 0.909831 0.809346 O\n0.792816 0.809911 0.394778 O\n0.776888 0.996128 0.997405 O\n0.733844 0.747013 0.273244 O\n0.458656 0.907631 0.092092 O\n0.093532 0.798018 0.189767 O\n0.238317 0.954977 0.475317 O\n0.373154 0.796094 0.904407 O\n0.878909 0.876580 0.575561 O\n0.943616 0.939444 0.759887 O\n0.279671 0.560867 0.994569 O\n0.152857 0.713368 0.574294 O\n0.001961 0.781976 0.000854 O\n0.888390 0.621286 0.669852 O\n0.161482 0.438647 0.852957 O\n0.459028 0.475779 0.727692 O\n0.905176 0.620808 0.807365 O\n0.522245 0.531401 0.906214 O\n0.817457 0.387870 0.908022 O\n0.563022 0.277360 0.002552 O\n0.424230 0.145624 0.852442 O\n",
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{
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