mp_ID stringlengths 4 10 | x float64 -10.28 17.7 | y float64 -12.01 23.9 | z float64 -8.99 7.96 | type stringclasses 2
values | formula stringlengths 2 26 | n_atoms int64 1 444 | spacegroup int64 1 230 | volume float64 5.61 20.1k |
|---|---|---|---|---|---|---|---|---|
mp-1214850 | 8.015892 | 2.49164 | -1.205599 | other | Be8N16F32 | 56 | 33 | 1,087.69 |
mp-1182697 | 7.17741 | 7.059622 | -4.101075 | other | Ba12Zn12O60 | 84 | 33 | 1,687.96 |
mp-780263 | 10.413467 | 7.893739 | 1.222806 | other | Ba24Ge12O48 | 84 | 33 | 1,503.56 |
mp-1245794 | 0.965349 | 2.33436 | 1.461725 | other | Li4Ir4N8 | 16 | 33 | 201.03 |
mp-504414 | 12.279539 | 8.985678 | -5.590979 | other | Mo8P8O40 | 56 | 33 | 919.1 |
mp-616185 | 1.338681 | 2.602963 | -5.87429 | other | Rb8Zn4Cl16 | 28 | 33 | 855.89 |
mp-770892 | 10.144253 | 9.205634 | -6.441168 | other | V8P8O40 | 56 | 33 | 832.59 |
mp-555514 | 8.421496 | 2.27853 | -0.969739 | other | Os4O4F20 | 28 | 33 | 383.12 |
mp-1245842 | 1.993821 | 2.522053 | 1.737318 | other | Ni4Ge4N8 | 16 | 33 | 178.35 |
mp-5029 | 8.585085 | 9.713239 | 1.929833 | other | Ho8Cu8O20 | 36 | 33 | 478.02 |
mp-27018 | 13.355867 | 6.761218 | -6.288706 | other | Sn8P8O32 | 48 | 33 | 750.12 |
mp-561057 | 13.007909 | 7.248956 | -6.467242 | other | Sb8P16O56 | 80 | 33 | 1,036.22 |
mp-1197254 | -7.029955 | -5.744797 | 3.86399 | other | Ca12Cu12Ge12 | 36 | 33 | 702.76 |
mp-787625 | 9.834175 | 0.921599 | 0.124085 | other | Li4Fe8F28 | 40 | 33 | 613.86 |
mp-1190244 | -2.620614 | -2.7573 | -5.590738 | other | Er4Sc4S12 | 20 | 33 | 422.5 |
mp-1199778 | 12.813749 | 6.603675 | -0.643357 | other | Mg8Si8O24 | 40 | 33 | 446.77 |
mp-1247093 | 1.308762 | 2.40262 | 1.735969 | other | Co4Sn4N8 | 16 | 33 | 211.8 |
mp-1120799 | -5.627411 | -3.175755 | 0.46478 | other | Ga4Fe4As8 | 16 | 33 | 340.16 |
mp-1019550 | 2.813163 | 2.475824 | 1.571263 | other | Be4Ge4N8 | 16 | 33 | 147.5 |
mp-1246005 | 0.502729 | 2.283603 | 1.987633 | other | Mn4Os4N8 | 16 | 33 | 171.45 |
mp-3120 | 8.553999 | 9.826947 | 1.986292 | other | Tm8Cu8O20 | 36 | 33 | 465.29 |
mp-767605 | 9.94302 | 2.130093 | 1.702658 | other | Li8V4F20 | 32 | 33 | 404.97 |
mp-849725 | 9.274591 | 8.038678 | -5.9827 | other | Co12P16O60 | 88 | 33 | 1,193.76 |
mp-1105648 | 1.785988 | 2.048223 | 0.658559 | other | Zn8Br4N4 | 16 | 33 | 298.08 |
mp-21459 | -4.170003 | -1.340827 | -5.900672 | other | In4Ag4S8 | 16 | 33 | 394.26 |
mp-755685 | 10.017435 | 8.397713 | 3.099046 | other | Sm4Y4O12 | 20 | 33 | 300.62 |
mp-1209603 | 8.206305 | 9.313862 | -3.804273 | other | Sm4Re12O64 | 80 | 33 | 1,484.39 |
mp-863748 | -2.882556 | -1.740336 | -5.662131 | other | Tb4B4S12 | 20 | 33 | 387.41 |
mp-1246331 | 1.083422 | 2.491463 | 1.681901 | other | Mg4Rh4N8 | 16 | 33 | 206.92 |
mp-554529 | 9.784142 | 9.923746 | 2.901923 | other | Ba24Ti12O48 | 84 | 33 | 1,500.56 |
mp-26792 | 11.205924 | 7.842497 | -7.033771 | other | Fe4P4O16 | 24 | 33 | 404.85 |
mp-21216 | 8.325286 | 12.929379 | -0.976305 | other | Al8Fe8O24 | 40 | 33 | 410.04 |
mp-728271 | 0.864008 | 2.014121 | -3.888941 | other | Al8Br28N4 | 40 | 33 | 1,584.71 |
mp-626256 | 7.810248 | 4.090517 | -4.53686 | other | H12N4O16 | 32 | 33 | 288.74 |
mp-642209 | 13.495506 | 7.689064 | -0.814205 | other | Mg8Si8O24 | 40 | 33 | 407.76 |
mp-1189646 | 8.295625 | 1.223068 | -3.969047 | other | Li4H8N4 | 16 | 33 | 129.32 |
mp-680577 | 1.70758 | 2.410991 | -5.28691 | other | K4Ga8Cl28 | 40 | 33 | 1,397.96 |
mp-1194679 | 9.385713 | 10.454301 | 0.345385 | other | K20Mn12O24 | 56 | 33 | 1,045.97 |
mp-1203343 | 8.383234 | 6.65096 | -4.008334 | other | K12B12O40 | 64 | 33 | 1,044.05 |
mp-19514 | 9.712404 | 10.863781 | 0.842941 | other | Sr16Cr8O32 | 56 | 33 | 825.24 |
mp-1189296 | -3.002875 | -1.702349 | -5.313455 | other | Ce4B4S12 | 20 | 33 | 415.12 |
mp-1188683 | -3.047578 | -1.614997 | -5.592228 | other | Nd4B4S12 | 20 | 33 | 407.91 |
mp-760202 | 9.624456 | 1.867636 | -0.069816 | other | Li4V4F24 | 32 | 33 | 421.6 |
mp-27650 | 6.180828 | 0.348704 | -3.348161 | other | Rb8B80H72 | 160 | 33 | 1,770.46 |
mp-1205111 | 7.911109 | 8.950957 | -3.48113 | other | Rb4Os8O36 | 48 | 33 | 851.91 |
mp-753611 | 3.171053 | 2.954888 | -4.39923 | other | P4Cl12O4 | 20 | 33 | 686.75 |
mp-626006 | 8.259789 | 4.336057 | -4.484924 | other | H16N8O12 | 36 | 33 | 502.53 |
mp-1188442 | -2.849974 | -2.54218 | -5.458983 | other | La4Yb4S12 | 20 | 33 | 498.76 |
mp-706430 | 7.692592 | 4.271534 | -4.493238 | other | H12N4O16 | 32 | 33 | 360.43 |
mp-568350 | 1.337327 | 2.612199 | -5.883488 | other | Rb24Zn12Cl48 | 84 | 33 | 2,786.42 |
mp-1020712 | 2.726856 | 2.351336 | 1.717584 | other | Zn4Si4N8 | 16 | 33 | 164.62 |
mp-1246669 | 0.879405 | 2.618665 | 1.705362 | other | Mg4Co4N8 | 16 | 33 | 181.33 |
mp-567291 | 8.638899 | 10.301033 | 1.865373 | other | Gd24Os8O56 | 88 | 33 | 1,194.46 |
mp-772788 | 7.182728 | 9.780393 | 0.380598 | other | Ba8Cu8O20 | 36 | 33 | 618.76 |
mp-621994 | 8.229665 | 11.001489 | 1.070598 | other | Nd8Os8O32 | 48 | 33 | 622.23 |
mp-1199083 | 5.355408 | 3.0778 | -3.627643 | other | C16N36O12 | 64 | 33 | 1,023.62 |
mp-1120729 | 1.455081 | 2.610503 | -5.795051 | other | Rb4Ge4Cl12 | 20 | 33 | 632.46 |
mp-647575 | 1.330854 | 2.443099 | -5.819444 | other | K24Zn12Cl48 | 84 | 33 | 2,505.92 |
mp-680053 | -0.967025 | 0.662383 | -4.084789 | other | Bi96Ru12Br80 | 188 | 33 | 6,672.17 |
mp-752882 | 9.126608 | 0.789631 | 0.642398 | other | Li4Ag4F8 | 16 | 33 | 229.47 |
mp-560040 | 10.466524 | 11.239279 | 3.179168 | other | Ca16Nb16O56 | 88 | 33 | 1,165.49 |
mp-771325 | 8.517143 | 9.758057 | 1.873223 | other | Dy8Cu8O20 | 36 | 33 | 484.92 |
mp-1246975 | 2.72026 | 2.33604 | 1.631339 | other | Cd4Si4N8 | 16 | 33 | 194.94 |
mp-1029404 | 2.51993 | 2.282413 | 1.452209 | other | K2Ge4N6 | 12 | 36 | 157.19 |
mp-21489 | 6.376983 | 8.657018 | -0.905775 | other | Rb4Pb2O6 | 12 | 36 | 245.39 |
mp-1198534 | 7.985229 | 5.073563 | -6.287954 | other | Y4C6O22 | 32 | 36 | 418.28 |
mp-1245459 | 0.759322 | 2.630682 | 1.834234 | other | Ga2Fe4N6 | 12 | 36 | 124.98 |
mp-1228670 | -4.463711 | -5.531701 | 0.49625 | other | K76Nb14As48 | 138 | 36 | 4,693.35 |
mp-505045 | -6.088046 | -3.492453 | -2.120445 | other | Na20In8Te24 | 52 | 36 | 1,647.4 |
mp-1246456 | 2.4677 | 2.356672 | 1.4718 | other | Cs2Ge4N6 | 12 | 36 | 174.07 |
mp-1367439 | 11.340857 | 13.357868 | -1.595473 | other | Mg6V4O14 | 24 | 36 | 245.16 |
mp-1245599 | 0.255952 | 2.505882 | 1.915096 | other | Fe2Co4N4 | 10 | 36 | 105.52 |
mp-1217268 | -2.674544 | -2.693139 | -5.86669 | other | Tm16Pb8S32 | 56 | 36 | 1,358.08 |
mp-757688 | 12.995853 | 10.588686 | 2.329104 | other | Ba4Nb32O56 | 92 | 36 | 1,213.3 |
mp-3258 | 8.208205 | 10.851522 | 1.080439 | other | Ca6Ru4O14 | 24 | 36 | 291.57 |
mp-21695 | -8.651398 | -0.15387 | 2.370228 | other | Ce2Ni24B12 | 38 | 36 | 382.21 |
mp-1246714 | 1.84043 | 2.338055 | 1.926619 | other | Al4Co2N6 | 12 | 36 | 127.63 |
mp-14433 | 2.483262 | 2.322684 | 1.568003 | other | Na2Ge4N6 | 12 | 36 | 146.36 |
mp-555918 | 10.278869 | 7.83361 | -3.056844 | other | Hg8Se4O12 | 24 | 36 | 464.56 |
mp-768223 | 9.45809 | 8.347135 | 0.581177 | other | Cs4Ce2O6 | 12 | 36 | 288.95 |
mp-10246 | -3.798858 | -1.246704 | -5.060849 | other | Na4Pt2S4 | 10 | 36 | 198.85 |
mp-510293 | 9.998031 | 8.154725 | -2.081593 | other | Pb6Se2O10 | 18 | 36 | 331.91 |
mp-1373149 | 12.725834 | 10.759191 | -0.292875 | other | Zn6W4O14 | 24 | 36 | 277.27 |
mp-1376713 | 12.321772 | 10.593993 | 0.413527 | other | Ca6Mo4O14 | 24 | 36 | 303.1 |
mp-760360 | 11.710406 | 9.480083 | 3.93337 | other | Hf6N4O6 | 16 | 36 | 226.27 |
mp-755391 | 9.158011 | 8.894451 | 0.515705 | other | Ba2Na4O4 | 10 | 36 | 197.77 |
mp-1214220 | -3.327531 | -2.366033 | -4.906655 | other | Ce4Fe4S10 | 18 | 36 | 345.88 |
mp-1246525 | 2.868024 | 2.420644 | 1.689825 | other | Si4Au2N6 | 12 | 36 | 136.3 |
mp-8154 | 9.915733 | 10.591403 | 3.374244 | other | La4Ti4O14 | 22 | 36 | 278.99 |
mp-4533 | 12.431225 | 6.280137 | -0.73053 | other | Na4Si2O6 | 12 | 36 | 151.98 |
mp-557578 | 12.76498 | 12.996392 | -1.08923 | other | Na2V12O22 | 36 | 36 | 373.6 |
mp-1202380 | -8.679995 | -0.15509 | 2.381309 | other | Dy2Ni24B12 | 38 | 36 | 376.41 |
mp-777522 | 10.332935 | 1.822513 | 2.211264 | original | Li2Fe2F6 | 10 | 36 | 117.01 |
mp-1194159 | -7.028205 | -4.625132 | 5.409542 | other | Y8Zn10Ge12 | 30 | 36 | 609.72 |
mp-21521 | 6.703805 | 8.641844 | -0.972772 | other | Cs4Pb2O6 | 12 | 36 | 272.6 |
mp-777786 | 6.558985 | 11.128324 | -1.371276 | other | Na8Co4O12 | 24 | 36 | 332.77 |
mp-13735 | 7.487777 | 8.572413 | -0.566636 | other | Rb4Tb2O6 | 12 | 36 | 267.31 |
mp-9248 | -4.579269 | -1.320931 | -5.950251 | other | Cu4Si2S6 | 12 | 36 | 214.45 |
mp-1245860 | 0.984889 | 2.356813 | 1.816112 | other | Zn4Ru2N6 | 12 | 36 | 144.15 |
mp-891926 | 7.198618 | 13.426935 | -1.048694 | other | Li10Ni8O16 | 34 | 36 | 290.03 |
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