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{
"id": "mp-1178005",
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"structure_string": "Li4 Cu8 S6\n1.0\n1.898769 7.420055 0.000000\n-1.898769 7.420055 0.000000\n0.000000 3.203059 9.506219\nLi Cu S\n4 8 6\ndirect\n0.835482 0.835482 0.849220 Li\n0.308414 0.308414 0.352248 Li\n0.691586 0.691586 0.647752 Li\n0.164518 0.164518 0.150780 Li\n0.484814 0.484814 0.881933 Cu\n0.469477 0.469477 0.635454 Cu\n0.898918 0.898918 0.513582 Cu\n0.898674 0.898674 0.099458 Cu\n0.101326 0.101326 0.900542 Cu\n0.101082 0.101082 0.486418 Cu\n0.530523 0.530523 0.364546 Cu\n0.515186 0.515186 0.118067 Cu\n0.970086 0.970086 0.274602 S\n0.318005 0.318005 0.622177 S\n0.338483 0.338483 0.043311 S\n0.661517 0.661517 0.956689 S\n0.681995 0.681995 0.377823 S\n0.029914 0.029914 0.725398 S\n",
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{
"id": "mp-1080374",
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"structure_string": "Ce24 Se48\n1.0\n7.238363 -12.270749 0.000000\n14.046015 0.015286 17.143399\n-6.807652 -12.286035 17.143399\nCe Se\n24 48\ndirect\n0.309255 0.259870 0.759870 Ce\n0.328995 0.740130 0.240130 Ce\n0.690745 0.740130 0.240130 Ce\n0.671005 0.259870 0.759870 Ce\n0.315486 0.118823 0.618823 Ce\n0.053131 0.881177 0.381177 Ce\n0.684514 0.881177 0.381177 Ce\n0.946869 0.118823 0.618823 Ce\n0.490508 0.270478 0.375176 Ce\n0.136163 0.729522 0.624824 Ce\n0.136163 0.124824 0.229522 Ce\n0.490508 0.875176 0.770478 Ce\n0.509492 0.729522 0.624824 Ce\n0.863837 0.270478 0.375176 Ce\n0.863837 0.875176 0.770478 Ce\n0.509492 0.124824 0.229522 Ce\n0.123595 0.493054 0.626613 Ce\n0.243262 0.506946 0.373387 Ce\n0.243262 0.873387 0.006946 Ce\n0.123595 0.126612 0.993054 Ce\n0.876405 0.506946 0.373387 Ce\n0.756738 0.493054 0.626613 Ce\n0.756738 0.126612 0.993054 Ce\n0.876405 0.873387 0.006946 Ce\n0.516293 0.233707 0.733707 Se\n0.483707 0.766293 0.266293 Se\n0.152990 0.097010 0.597010 Se\n0.847010 0.902990 0.402990 Se\n0.670574 0.298820 0.360033 Se\n0.329426 0.701180 0.639967 Se\n0.329426 0.139967 0.201180 Se\n0.670574 0.860033 0.798820 Se\n0.948009 0.456212 0.647770 Se\n0.051991 0.543788 0.352230 Se\n0.051991 0.852230 0.043788 Se\n0.948009 0.147770 0.956212 Se\n0.250095 0.198062 0.698062 Se\n0.146219 0.801938 0.301938 Se\n0.749905 0.801938 0.301938 Se\n0.853781 0.198062 0.698062 Se\n0.433425 0.181354 0.500000 Se\n0.114779 0.818646 0.500000 Se\n0.114779 -0.000000 0.318646 Se\n0.433425 0.000000 0.681354 Se\n0.566575 0.818646 0.500000 Se\n0.885221 0.181354 0.500000 Se\n0.885221 0.000000 0.681354 Se\n0.566575 -0.000000 0.318646 Se\n0.500000 0.220819 0.279181 Se\n0.000000 0.779181 0.720819 Se\n1.000000 0.220819 0.279181 Se\n0.500000 0.779181 0.720819 Se\n0.341786 0.385078 0.357366 Se\n0.084230 0.614922 0.642634 Se\n0.084230 0.142634 0.114922 Se\n0.341786 0.857366 0.885078 Se\n0.658214 0.614922 0.642634 Se\n0.915770 0.385078 0.357366 Se\n0.915770 0.857366 0.885078 Se\n0.658214 0.142634 0.114922 Se\n0.235388 0.500000 0.500000 Se\n0.235388 1.000000 0.000000 Se\n0.764612 0.500000 0.500000 Se\n0.764612 0.000000 1.000000 Se\n0.236934 0.396311 0.714244 Se\n0.347490 0.603689 0.285756 Se\n0.347490 0.785756 0.103689 Se\n0.236934 0.214244 0.896311 Se\n0.763066 0.603689 0.285756 Se\n0.652510 0.396311 0.714244 Se\n0.652510 0.214244 0.896311 Se\n0.763066 0.785756 0.103689 Se\n",
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{
"id": "mp-17667",
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"structure_string": "Sr12 Al4 Sb12\n1.0\n3.482557 -10.316190 0.000000\n3.482557 10.316190 0.000000\n0.000000 0.000000 13.638814\nSr Al Sb\n12 4 12\ndirect\n0.810136 0.810136 0.354100 Sr\n0.310136 0.310136 0.145900 Sr\n0.689864 0.689864 0.854100 Sr\n0.189864 0.189864 0.645900 Sr\n0.478643 0.126744 0.870887 Sr\n0.626744 0.978643 0.629113 Sr\n0.021357 0.373256 0.370887 Sr\n0.873256 0.521357 0.129113 Sr\n0.521357 0.873256 0.129113 Sr\n0.373256 0.021357 0.370887 Sr\n0.978643 0.626744 0.629113 Sr\n0.126744 0.478643 0.870887 Sr\n0.086287 0.913713 0.000000 Al\n0.413713 0.586287 0.500000 Al\n0.913713 0.086287 0.000000 Al\n0.586287 0.413713 0.500000 Al\n0.287938 0.287938 0.392413 Sb\n0.787938 0.787938 0.107587 Sb\n0.212062 0.212062 0.892413 Sb\n0.712062 0.712062 0.607587 Sb\n0.948620 0.627488 0.877230 Sb\n0.127488 0.448620 0.622770 Sb\n0.551380 0.872512 0.377230 Sb\n0.372512 0.051380 0.122770 Sb\n0.051380 0.372512 0.122770 Sb\n0.872512 0.551380 0.377230 Sb\n0.448620 0.127488 0.622770 Sb\n0.627488 0.948620 0.877230 Sb\n",
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"density": 4.4402436197198405,
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"volume": 979.9956951776792,
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"formula_full": "Sr12 Al4 Sb12",
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{
"id": "mp-600037",
"created_at": "2022-09-04T14:44:41.429146Z",
"structure_string": "Si16 O32\n1.0\n-2.645325 7.056809 13.093287\n2.645325 -7.056809 13.093287\n2.645325 7.056809 -13.093287\nSi O\n16 32\ndirect\n0.922908 0.783821 0.139087 Si\n0.855266 0.216179 0.639087 Si\n0.077092 0.216179 0.860913 Si\n0.144734 0.783821 0.360913 Si\n0.901301 0.441313 0.459988 Si\n0.518675 0.558687 0.959988 Si\n0.098699 0.558687 0.540012 Si\n0.481325 0.441313 0.040012 Si\n0.947434 0.893979 0.053455 Si\n0.659476 0.106021 0.553455 Si\n0.052566 0.106021 0.946545 Si\n0.340524 0.893979 0.446545 Si\n0.275485 0.525485 0.750000 Si\n0.724515 0.474515 0.250000 Si\n0.205343 0.955343 0.250000 Si\n0.794657 0.044657 0.750000 Si\n0.052363 0.802363 0.250000 O\n0.947637 0.197637 0.750000 O\n0.076981 0.919945 0.157036 O\n0.737090 0.080055 0.657036 O\n0.923019 0.080055 0.842964 O\n0.262910 0.919945 0.342964 O\n0.240159 0.240557 0.500397 O\n0.759841 0.759443 0.499603 O\n0.759841 0.260238 0.000397 O\n0.240159 0.739762 0.999603 O\n0.867583 0.500000 0.867583 O\n0.132417 0.000000 0.632417 O\n0.132417 0.500000 0.132417 O\n0.867583 0.000000 0.367583 O\n0.900427 0.832498 0.067929 O\n0.735431 0.167502 0.567929 O\n0.099573 0.167502 0.932071 O\n0.264569 0.832498 0.432071 O\n0.000000 0.500000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.215689 0.560440 0.655248 O\n0.594808 0.439560 0.155248 O\n0.784311 0.439560 0.344752 O\n0.405192 0.560440 0.844752 O\n0.907057 0.161290 0.245639 O\n0.584349 0.838710 0.245767 O\n0.092943 0.338582 0.254233 O\n0.415651 0.661418 0.254361 O\n0.092943 0.838710 0.754361 O\n0.415651 0.161290 0.754233 O\n0.907057 0.661418 0.745767 O\n0.584349 0.338582 0.745639 O\n",
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{
"id": "mp-1080534",
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"structure_string": "Cs2 Li3 I5\n1.0\n2.374101 8.479890 0.000000\n-2.374101 8.479890 0.000000\n0.000000 4.829014 10.111079\nCs Li I\n2 3 5\ndirect\n0.312698 0.312698 0.232580 Cs\n0.687302 0.687302 0.767420 Cs\n0.500000 0.500000 0.500000 Li\n0.050306 0.050306 0.203349 Li\n0.949694 0.949694 0.796651 Li\n0.000000 0.000000 0.000000 I\n0.099384 0.099384 0.565005 I\n0.900616 0.900616 0.434995 I\n0.636040 0.636040 0.204500 I\n0.363960 0.363960 0.795500 I\n",
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"volume": 407.11481705503553,
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"formula_full": "Cs2 Li3 I5",
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{
"id": "mp-1040348",
"created_at": "2022-09-04T14:44:41.618056Z",
"structure_string": "K1 Li1 Mg30 O31\n1.0\n8.585854 0.000000 0.000000\n0.000000 8.587261 0.000000\n0.000000 0.000000 8.635450\nK Li Mg O\n1 1 30 31\ndirect\n0.000000 0.004432 0.000000 K\n0.500000 0.003219 0.500000 Li\n0.500000 0.021171 0.000000 Mg\n0.000000 0.001425 0.500000 Mg\n0.000000 0.500114 0.000000 Mg\n0.500000 0.479954 0.000000 Mg\n0.000000 0.498804 0.500000 Mg\n0.500000 0.498603 0.500000 Mg\n0.254428 0.998604 0.255534 Mg\n0.745572 0.998604 0.255534 Mg\n0.254428 0.998604 0.744466 Mg\n0.745572 0.998604 0.744466 Mg\n0.250953 0.500868 0.250664 Mg\n0.749047 0.500868 0.250664 Mg\n0.250953 0.500868 0.749336 Mg\n0.749047 0.500868 0.749336 Mg\n0.229326 0.750548 0.000000 Mg\n0.770674 0.750548 0.000000 Mg\n0.249364 0.753010 0.500000 Mg\n0.750636 0.753010 0.500000 Mg\n0.248418 0.251417 0.000000 Mg\n0.751582 0.251417 0.000000 Mg\n0.251866 0.245890 0.500000 Mg\n0.748134 0.245890 0.500000 Mg\n0.000000 0.750031 0.256168 Mg\n0.500000 0.756472 0.274268 Mg\n0.000000 0.750031 0.743832 Mg\n0.500000 0.756472 0.725732 Mg\n0.000000 0.250555 0.253701 Mg\n0.500000 0.244510 0.256842 Mg\n0.000000 0.250555 0.746299 Mg\n0.500000 0.244510 0.743158 Mg\n0.000000 0.726830 0.000000 O\n0.000000 0.743870 0.500000 O\n0.500000 0.740428 0.500000 O\n0.000000 0.275665 0.000000 O\n0.500000 0.251963 0.000000 O\n0.000000 0.255292 0.500000 O\n0.500000 0.258846 0.500000 O\n0.254669 0.749257 0.245688 O\n0.745331 0.749257 0.245688 O\n0.254669 0.749257 0.754312 O\n0.745331 0.749257 0.754312 O\n0.251350 0.249832 0.247201 O\n0.748650 0.249832 0.247201 O\n0.251350 0.249832 0.752799 O\n0.748650 0.249832 0.752799 O\n0.277128 0.985975 0.000000 O\n0.722872 0.985975 0.000000 O\n0.249901 0.998575 0.500000 O\n0.750099 0.998575 0.500000 O\n0.260811 0.507517 0.000000 O\n0.739189 0.507517 0.000000 O\n0.251590 0.500849 0.500000 O\n0.748410 0.500849 0.500000 O\n0.000000 0.997896 0.272605 O\n0.500000 0.995609 0.243920 O\n0.000000 0.997896 0.727395 O\n0.500000 0.995609 0.756080 O\n0.000000 0.501523 0.252561 O\n0.500000 0.507195 0.243280 O\n0.000000 0.501523 0.747439 O\n0.500000 0.507195 0.756720 O\n",
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{
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"structure_string": "Ba4 V2 P4 O22\n1.0\n8.925655 0.000000 0.000000\n0.000000 5.171853 0.000000\n0.000000 0.364734 10.592192\nBa V P O\n4 2 4 22\ndirect\n0.010831 0.025438 0.951626 Ba\n0.510831 0.974562 0.048374 Ba\n0.651417 0.999285 0.620240 Ba\n0.151417 0.000715 0.379760 Ba\n0.995435 0.444725 0.671720 V\n0.495435 0.555275 0.328280 V\n0.715304 0.500091 0.855677 P\n0.215304 0.499909 0.144323 P\n0.351251 0.457228 0.589193 P\n0.851251 0.542772 0.410807 P\n0.071783 0.554412 0.801351 O\n0.571783 0.445588 0.198649 O\n0.957155 0.130809 0.700203 O\n0.457155 0.869191 0.299797 O\n0.783893 0.543794 0.717882 O\n0.283893 0.456206 0.282118 O\n0.183137 0.380305 0.572417 O\n0.683137 0.619695 0.427583 O\n0.939142 0.672702 0.522697 O\n0.439142 0.327298 0.477303 O\n0.565198 0.648568 0.853414 O\n0.065198 0.351432 0.146586 O\n0.813285 0.627825 0.955450 O\n0.313285 0.372175 0.044550 O\n0.704005 0.206621 0.880585 O\n0.204005 0.793379 0.119415 O\n0.420300 0.329134 0.711451 O\n0.920300 0.670866 0.288549 O\n0.372973 0.748484 0.577611 O\n0.872973 0.251516 0.422389 O\n0.307721 0.063877 0.836563 O\n0.807721 0.936123 0.163437 O\n",
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{
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}