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{
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{
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"structure_string": "Li6 Ni4 P14 O42\n1.0\n6.867129 0.000000 0.000000\n2.555764 6.447266 0.000000\n3.200566 0.048501 18.230005\nLi Ni P O\n6 4 14 42\ndirect\n0.276293 0.209447 0.244123 Li\n0.437221 0.735910 0.449088 Li\n0.811481 0.113511 0.124068 Li\n0.188519 0.886489 0.875932 Li\n0.562779 0.264090 0.550912 Li\n0.723707 0.790553 0.755877 Li\n0.619555 0.172585 0.382528 Ni\n0.331658 0.880132 0.127036 Ni\n0.668342 0.119868 0.872964 Ni\n0.380445 0.827415 0.617472 Ni\n0.306766 0.272800 0.025338 P\n0.203249 0.222393 0.502622 P\n0.989575 0.325131 0.927337 P\n0.089540 0.581526 0.601498 P\n0.051425 0.891313 0.282640 P\n0.343082 0.160273 0.733127 P\n0.457953 0.544189 0.251849 P\n0.542047 0.455811 0.748151 P\n0.656918 0.839727 0.266873 P\n0.948575 0.108687 0.717360 P\n0.910460 0.418474 0.398502 P\n0.010425 0.674869 0.072663 P\n0.796751 0.777607 0.497378 P\n0.693234 0.727200 0.974662 P\n0.111611 0.236302 0.998093 O\n0.994475 0.271072 0.467106 O\n0.317187 0.176840 0.100762 O\n0.065090 0.358873 0.330269 O\n0.236985 0.520599 0.031410 O\n0.053565 0.862618 0.094389 O\n0.105795 0.352116 0.577811 O\n0.286323 0.992935 0.517736 O\n0.088779 0.222846 0.744813 O\n0.504592 0.208238 0.970100 O\n0.128601 0.008996 0.219413 O\n0.251851 0.701025 0.305795 O\n0.353494 0.315621 0.458217 O\n0.100484 0.436699 0.875711 O\n0.318699 0.568924 0.592891 O\n0.419520 0.583813 0.174000 O\n0.445728 0.071938 0.656510 O\n0.428021 0.034255 0.797972 O\n0.067938 0.983968 0.650772 O\n0.507280 0.326448 0.281035 O\n0.353561 0.387098 0.732787 O\n0.646439 0.612902 0.267213 O\n0.492720 0.673552 0.718965 O\n0.932062 0.016032 0.349228 O\n0.571979 0.965745 0.202028 O\n0.554272 0.928062 0.343490 O\n0.580480 0.416187 0.826000 O\n0.681301 0.431076 0.407109 O\n0.899516 0.563301 0.124289 O\n0.646506 0.684379 0.541783 O\n0.748149 0.298975 0.694205 O\n0.871399 0.991004 0.780587 O\n0.495408 0.791762 0.029900 O\n0.911221 0.777154 0.255187 O\n0.713677 0.007065 0.482264 O\n0.894205 0.647884 0.422189 O\n0.946435 0.137382 0.905611 O\n0.763015 0.479401 0.968590 O\n0.934910 0.641127 0.669731 O\n0.682813 0.823160 0.899238 O\n0.005525 0.728928 0.532894 O\n0.888389 0.763698 0.001907 O\n",
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{
"id": "mp-567794",
"created_at": "2022-09-04T14:39:14.477527Z",
"structure_string": "Zn4 H64 C16 Br16 N8\n1.0\n12.259632 0.000000 0.000000\n0.000000 8.943297 0.000000\n0.000000 8.904052 14.049557\nZn H C Br N\n4 64 16 16 8\ndirect\n0.799576 0.258761 0.919184 Zn\n0.200424 0.741239 0.080816 Zn\n0.700424 0.258761 0.419184 Zn\n0.299576 0.741239 0.580816 Zn\n0.697571 0.560674 0.571464 H\n0.990576 0.779304 0.259771 H\n0.316037 0.563950 0.864787 H\n0.490576 0.220696 0.240229 H\n0.183963 0.563950 0.364787 H\n0.900266 0.774388 0.814417 H\n0.578230 0.918681 0.790764 H\n0.042991 0.394251 0.317344 H\n0.925612 0.969846 0.870102 H\n0.716019 0.823803 0.043893 H\n0.400266 0.225612 0.685583 H\n0.977512 0.718247 0.556565 H\n0.802429 0.560674 0.071464 H\n0.425612 0.030154 0.629898 H\n0.783981 0.823803 0.543893 H\n0.175119 0.398436 0.489950 H\n0.216019 0.176197 0.456107 H\n0.476635 0.330904 0.576806 H\n0.957009 0.605749 0.682656 H\n0.599734 0.774388 0.314417 H\n0.324881 0.398436 0.989950 H\n0.932045 0.103385 0.698558 H\n0.023365 0.330904 0.076806 H\n0.054817 0.157387 0.390578 H\n0.445183 0.157387 0.890578 H\n0.067955 0.896615 0.301442 H\n0.228535 0.327924 0.338292 H\n0.046156 0.753567 0.812082 H\n0.561779 0.060300 0.622845 H\n0.522488 0.718247 0.056565 H\n0.683963 0.436050 0.135213 H\n0.283981 0.176197 0.956107 H\n0.302429 0.439326 0.428536 H\n0.675119 0.601564 0.010050 H\n0.078230 0.081319 0.709236 H\n0.061779 0.939700 0.877155 H\n0.421770 0.081319 0.209236 H\n0.554817 0.842613 0.109422 H\n0.074388 0.030154 0.129898 H\n0.976635 0.669096 0.923194 H\n0.477512 0.281753 0.943435 H\n0.546156 0.246433 0.687918 H\n0.197571 0.439326 0.928536 H\n0.509424 0.779304 0.759771 H\n0.271465 0.327924 0.838292 H\n0.457009 0.394251 0.817344 H\n0.542991 0.605749 0.182656 H\n0.438221 0.939700 0.377155 H\n0.432045 0.896615 0.801442 H\n0.938221 0.060300 0.122845 H\n0.771465 0.672076 0.661708 H\n0.523365 0.669096 0.423194 H\n0.453844 0.753567 0.312082 H\n0.728535 0.672076 0.161708 H\n0.921770 0.918681 0.290764 H\n0.574388 0.969846 0.370102 H\n0.099734 0.225612 0.185583 H\n0.567955 0.103385 0.198558 H\n0.953844 0.246433 0.187918 H\n0.009424 0.220696 0.740229 H\n0.022488 0.281753 0.443435 H\n0.816037 0.436050 0.635213 H\n0.945183 0.842613 0.609422 H\n0.824881 0.601564 0.510050 H\n0.996443 0.900507 0.260748 C\n0.522338 0.773696 0.347561 C\n0.503557 0.900507 0.760748 C\n0.213694 0.434994 0.422377 C\n0.477662 0.226304 0.652439 C\n0.022338 0.226304 0.152439 C\n0.568439 0.718095 0.113076 C\n0.977662 0.773696 0.847561 C\n0.431561 0.281905 0.886924 C\n0.496443 0.099493 0.239252 C\n0.931561 0.718095 0.613076 C\n0.786306 0.565006 0.577623 C\n0.003557 0.099493 0.739252 C\n0.713694 0.565006 0.077623 C\n0.068439 0.281905 0.386924 C\n0.286306 0.434994 0.922377 C\n0.212546 0.455574 0.679752 Br\n0.246221 0.883431 0.413635 Br\n0.746221 0.116569 0.086365 Br\n0.253779 0.883431 0.913635 Br\n0.762881 0.048467 0.374649 Br\n0.495977 0.710733 0.597651 Br\n0.753779 0.116569 0.586365 Br\n0.504023 0.289267 0.402349 Br\n0.712546 0.544426 0.820248 Br\n0.995977 0.289267 0.902349 Br\n0.787454 0.544426 0.320248 Br\n0.287454 0.455574 0.179752 Br\n0.237119 0.951533 0.625351 Br\n0.004023 0.710733 0.097651 Br\n0.737119 0.048467 0.874649 Br\n0.262881 0.951533 0.125351 Br\n0.007809 0.053095 0.160791 N\n0.187286 0.297854 0.400419 N\n0.492191 0.053095 0.660791 N\n0.312714 0.297854 0.900419 N\n0.812714 0.702146 0.599581 N\n0.507809 0.946905 0.339209 N\n0.687286 0.702146 0.099581 N\n0.992191 0.946905 0.839209 N\n",
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{
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"structure_string": "Ba4 Ca8 P24 N48\n1.0\n10.016486 0.000000 0.000000\n0.000000 10.016486 0.000000\n0.000000 0.000000 10.016486\nBa Ca P N\n4 8 24 48\ndirect\n0.000000 0.500000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.500000 0.000000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.375091 0.124909 0.875091 Ca\n0.124909 0.875091 0.375091 Ca\n0.875091 0.375091 0.124909 Ca\n0.624909 0.624909 0.624909 Ca\n0.624909 0.875091 0.124909 Ca\n0.875091 0.124909 0.624909 Ca\n0.124909 0.624909 0.875091 Ca\n0.375091 0.375091 0.375091 Ca\n0.689888 0.346718 0.380463 P\n0.189888 0.153282 0.619537 P\n0.310112 0.846718 0.119537 P\n0.153282 0.619537 0.189888 P\n0.119537 0.310112 0.846718 P\n0.619537 0.189888 0.153282 P\n0.346718 0.380463 0.689888 P\n0.380463 0.689888 0.346718 P\n0.846718 0.119537 0.310112 P\n0.653282 0.880463 0.810112 P\n0.880463 0.810112 0.653282 P\n0.810112 0.653282 0.880463 P\n0.310112 0.653282 0.619537 P\n0.810112 0.846718 0.380463 P\n0.689888 0.153282 0.880463 P\n0.846718 0.380463 0.810112 P\n0.880463 0.689888 0.153282 P\n0.380463 0.810112 0.846718 P\n0.653282 0.619537 0.310112 P\n0.619537 0.310112 0.653282 P\n0.153282 0.880463 0.689888 P\n0.346718 0.119537 0.189888 P\n0.119537 0.189888 0.346718 P\n0.189888 0.346718 0.119537 P\n0.715134 0.506969 0.411471 N\n0.215134 0.993031 0.588529 N\n0.284866 0.006969 0.088529 N\n0.993031 0.588529 0.215134 N\n0.088529 0.284866 0.006969 N\n0.588529 0.215134 0.993031 N\n0.506969 0.411471 0.715134 N\n0.411471 0.715134 0.506969 N\n0.006969 0.088529 0.284866 N\n0.493031 0.911471 0.784866 N\n0.911471 0.784866 0.493031 N\n0.784866 0.493031 0.911471 N\n0.284866 0.493031 0.588529 N\n0.784866 0.006969 0.411471 N\n0.715134 0.993031 0.911471 N\n0.006969 0.411471 0.784866 N\n0.911471 0.715134 0.993031 N\n0.411471 0.784866 0.006969 N\n0.493031 0.588529 0.284866 N\n0.588529 0.284866 0.493031 N\n0.165480 0.731056 0.621097 N\n0.993031 0.911471 0.715134 N\n0.088529 0.215134 0.506969 N\n0.215134 0.506969 0.088529 N\n0.834520 0.268944 0.378903 N\n0.334520 0.231056 0.621097 N\n0.165480 0.768944 0.121097 N\n0.231056 0.621097 0.334520 N\n0.121097 0.165480 0.768944 N\n0.621097 0.334520 0.231056 N\n0.268944 0.378903 0.834520 N\n0.378903 0.834520 0.268944 N\n0.768944 0.121097 0.165480 N\n0.731056 0.878903 0.665480 N\n0.878903 0.665480 0.731056 N\n0.665480 0.731056 0.878903 N\n0.334520 0.268944 0.121097 N\n0.121097 0.334520 0.268944 N\n0.268944 0.121097 0.334520 N\n0.231056 0.878903 0.834520 N\n0.621097 0.165480 0.731056 N\n0.731056 0.621097 0.165480 N\n0.378903 0.665480 0.768944 N\n0.878903 0.834520 0.231056 N\n0.768944 0.378903 0.665480 N\n0.834520 0.231056 0.878903 N\n0.665480 0.768944 0.378903 N\n0.506969 0.088529 0.215134 N\n",
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{
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{
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