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-1200344 | -5.904287 | 1.529576 | -4.743559 | other | Tl4Mo18S22 | 44 | 167 | 917.28 |
mp-553922 | -5.923131 | 1.477845 | -4.70985 | other | K4Mo30S38 | 72 | 167 | 1,476.65 |
mp-645282 | -0.486167 | 1.141852 | -4.405991 | other | Al6Bi10Br24 | 40 | 167 | 1,396.24 |
mp-558489 | 10.599937 | 9.912738 | 3.836134 | other | Ca12Hf38O88 | 138 | 167 | 1,709.6 |
mp-6910 | 7.125291 | 8.369367 | -0.468439 | other | Ba2Pr2O6 | 10 | 167 | 189.81 |
mp-561550 | 11.716516 | 6.806495 | -2.624418 | other | Ag12B4O12 | 28 | 167 | 382.06 |
mp-28898 | 4.454572 | 1.905863 | -2.441423 | other | Ba6C6N12 | 24 | 167 | 501.33 |
mp-1190711 | -8.54608 | -6.364562 | 2.484646 | other | Sr4Zn6Au12 | 22 | 167 | 470.61 |
mp-541738 | -1.280355 | 3.089897 | -2.934725 | other | Cs6Cr4I18 | 28 | 167 | 1,200.52 |
mp-1247308 | 4.700859 | 2.198903 | -3.138411 | other | Ni4C6N12 | 22 | 167 | 228.32 |
mp-7027 | 13.688195 | 4.802227 | -2.54065 | other | In2B2O6 | 10 | 167 | 105.35 |
mp-16625 | -8.148251 | -5.101284 | 4.206829 | other | Yb2Al14Au6 | 22 | 167 | 404.21 |
mp-779428 | 9.493104 | 8.996552 | 3.266631 | other | Sr8Hf2O12 | 22 | 167 | 353.91 |
mp-1105760 | 1.596036 | 2.412394 | 0.192236 | other | Rb6La2N12 | 20 | 167 | 578.04 |
mp-29219 | -8.35029 | -0.021892 | 2.861383 | other | Ba4Ni18B12 | 34 | 167 | 421.55 |
mp-22711 | -8.201651 | -5.011155 | 4.357559 | other | Gd2Al14Au6 | 22 | 167 | 393.95 |
mp-561725 | 13.627277 | 4.685478 | -2.074187 | other | Cs6B6O12 | 24 | 167 | 453.01 |
mp-1195789 | 8.150881 | 7.180896 | -2.373233 | other | Sr30I12O72 | 114 | 167 | 1,715.13 |
mp-540659 | 13.65798 | 4.323993 | -1.9562 | other | Ba6B12O24 | 42 | 167 | 602.19 |
mp-1195471 | 10.913736 | 11.718339 | 3.089103 | other | K4Ta8O22 | 34 | 167 | 422.95 |
mp-861444 | 14.417751 | 9.088438 | -6.017862 | other | V6P6O24 | 36 | 167 | 449.59 |
mp-1190418 | -4.412565 | -3.417819 | -3.574264 | other | Ba8U2Se12 | 22 | 167 | 746.68 |
mp-2713773 | 11.877041 | 3.594208 | -7.859872 | other | La12S18O72 | 102 | 167 | 1,998.47 |
mp-1190798 | 5.039637 | 2.05496 | -3.096268 | other | Cr4C6N12 | 22 | 167 | 248.56 |
mp-989611 | 0.947087 | 2.337602 | 1.871764 | other | Y2Re2N6 | 10 | 167 | 118.41 |
mp-1196062 | 8.296476 | 7.349222 | -2.66404 | other | Ca30I12O72 | 114 | 167 | 1,514.46 |
mp-1189669 | 1.597431 | 2.438573 | 0.201251 | other | Rb6Y2N12 | 20 | 167 | 546.01 |
mp-3336 | 10.173779 | 8.812531 | 1.956741 | other | La2Ga2O6 | 10 | 167 | 121.63 |
mp-26962 | 10.749631 | 9.383666 | -7.110515 | other | V4P6O24 | 34 | 167 | 442.19 |
mp-27957 | 8.82917 | 9.467988 | 1.625239 | original | Ba6Ni2O8 | 16 | 167 | 307.15 |
mp-18867 | 10.582688 | 10.966108 | 0.187317 | other | Ba6W4O18 | 28 | 167 | 421.44 |
mp-1199935 | -3.096456 | 0.789751 | -3.791009 | other | Sr4Re12S22 | 38 | 167 | 764.9 |
mp-1193676 | 1.726069 | 2.517305 | 0.152206 | other | Cs6Sm4N18 | 28 | 167 | 719.44 |
mp-1203120 | 6.142991 | 5.22273 | -4.461286 | other | Np2N8O22 | 32 | 167 | 485.81 |
mp-683987 | 1.79418 | 1.995949 | 1.971259 | other | Ce30B16N50 | 96 | 167 | 1,285.66 |
mp-1188875 | -5.484334 | -2.281359 | -2.187271 | other | Te12Ir2I6 | 20 | 167 | 795.24 |
mp-998422 | 9.306142 | 0.664872 | 0.160269 | other | Cu2Ag2F6 | 10 | 167 | 121 |
mp-651409 | 1.89655 | 2.623744 | -4.58104 | other | Hf6Te12Cl72 | 90 | 167 | 3,562.56 |
mp-16432 | 13.293456 | 4.807392 | -1.519815 | other | Sr6B4O12 | 22 | 167 | 296.96 |
mp-1192012 | 2.586306 | 2.184239 | 1.540227 | other | Gd6B6N12 | 24 | 167 | 275.89 |
mp-2713752 | 11.608269 | 4.362247 | -7.861825 | other | Al12S18O72 | 102 | 167 | 1,272.27 |
mp-15011 | -2.829257 | -0.78935 | -5.414588 | other | Na6B6S12 | 24 | 167 | 488.76 |
mp-1202213 | -4.414455 | -6.390333 | 1.932802 | other | Cs16Ga22Cl2 | 40 | 167 | 1,530.34 |
mp-29775 | 7.553035 | 10.160498 | 1.174207 | other | Sr8Pd2O12 | 22 | 167 | 326.4 |
mp-23392 | 1.310999 | 2.430956 | -5.752808 | other | K8Cd2Cl12 | 22 | 167 | 631.4 |
mp-768453 | 12.271257 | 3.804443 | -8.017695 | other | Lu4S6O24 | 34 | 167 | 540.44 |
mp-566185 | -5.700788 | 1.193393 | -4.675529 | other | Rb4Mo30S38 | 72 | 167 | 1,604.54 |
mp-3466 | 10.651708 | 8.657433 | 2.451275 | other | Pr2Al2O6 | 10 | 167 | 107.1 |
mp-4598 | 8.080996 | 10.024003 | 1.255638 | other | Sr8Pt2O12 | 22 | 167 | 328.66 |
mp-1101339 | 10.808206 | 8.384985 | 1.692354 | other | Tb2Ga2O6 | 10 | 167 | 113.8 |
mp-866871 | -3.290471 | -1.806722 | -5.690343 | other | Ca8Sn2S12 | 22 | 167 | 502.38 |
mp-9716 | 14.146614 | 7.784958 | -1.795506 | other | Ti2B2O6 | 10 | 167 | 95.7 |
mp-559134 | -3.122177 | -1.457585 | -5.327631 | other | Eu6As4S16 | 26 | 167 | 672.6 |
mp-756585 | 10.505201 | 11.178158 | -0.183306 | other | Sr6W4O18 | 28 | 167 | 392.24 |
mp-759887 | 6.152743 | 11.384331 | 0.156481 | other | Sr18Ni14O42 | 74 | 167 | 946.94 |
mp-1245974 | 5.033241 | 2.12308 | -2.773005 | other | Ga4C6N12 | 22 | 167 | 261.49 |
mp-1203398 | 11.092235 | 11.784576 | 2.814909 | other | Ta8Ag4O22 | 34 | 167 | 413.05 |
mp-772512 | 10.71677 | 8.141708 | -7.31738 | other | Fe6P6O24 | 36 | 167 | 440.81 |
mp-11033 | -8.166508 | -5.045403 | 4.277568 | other | Tb2Al14Au6 | 22 | 167 | 401.57 |
mp-5899 | 10.597658 | 8.665103 | 2.593649 | other | Nd2Al2O6 | 10 | 167 | 105.75 |
mp-771136 | 9.035762 | 6.690995 | -3.793156 | other | Ho4Se6O24 | 34 | 167 | 642.29 |
mp-989461 | 4.96573 | 2.202814 | -3.10276 | other | B4C6N12 | 22 | 167 | 322.31 |
mp-1190733 | 1.364689 | 2.729582 | -6.014694 | other | Cs8Pb2Cl12 | 22 | 167 | 848.91 |
mp-22930 | 1.33339 | 2.572662 | -5.862686 | other | Rb8Cd2Cl12 | 22 | 167 | 704.31 |
mp-607712 | 4.803136 | 1.996944 | -2.626746 | other | Lu4C6N12 | 22 | 167 | 329.45 |
mp-1190683 | 2.689498 | 2.75042 | -3.873565 | other | Cd2Br12N8 | 22 | 167 | 665.1 |
mp-13619 | -5.488732 | -3.126511 | 5.633843 | other | Sc2Si14Rh6 | 22 | 167 | 327.71 |
mp-9812 | 8.62174 | 3.916802 | -6.827354 | other | Zn2C2O6 | 10 | 167 | 93.45 |
mp-21767 | 11.988965 | 6.749778 | -1.086018 | other | Si12Pb18O42 | 72 | 167 | 1,148.83 |
mp-27271 | 11.992338 | 7.609079 | -1.335563 | other | Tl16Ge10O28 | 54 | 167 | 1,069.63 |
mp-1247219 | 4.956652 | 2.252843 | -3.345939 | other | Co4C6N12 | 22 | 167 | 220.32 |
mp-38220 | 6.30858 | 4.975667 | -4.462605 | other | Rb2N2O6 | 10 | 167 | 182.1 |
mp-1246752 | 4.838687 | 2.165761 | -3.124866 | other | Rh4C6N12 | 22 | 167 | 254.57 |
mp-779545 | 8.741724 | 9.410527 | -0.083192 | other | Na6Cu2O4 | 12 | 167 | 179.92 |
mp-3408 | 11.212841 | 8.767036 | 2.337245 | other | Ce2Al2O6 | 10 | 167 | 106.89 |
mp-779073 | 10.485087 | 0.859299 | 1.607807 | other | Li6Mn6F18 | 30 | 167 | 359.99 |
mp-1190659 | -8.647083 | -6.204006 | 2.679618 | other | Eu4Al6Au12 | 22 | 167 | 458.47 |
mp-1078634 | 7.783596 | 11.039904 | 1.482789 | other | La2Fe2O6 | 10 | 167 | 115.45 |
mp-556288 | 12.154872 | 11.088024 | 0.188125 | other | Li4Re2O6 | 12 | 167 | 108.11 |
mp-38035 | 8.651048 | 3.558167 | -7.083416 | other | Sr2C2O6 | 10 | 167 | 148.78 |
mp-772269 | 10.707311 | 8.391464 | -7.844583 | other | Mn6P6O24 | 36 | 167 | 450.38 |
mp-998418 | 8.871249 | 0.798138 | 1.003899 | other | Mg2Ag2F6 | 10 | 167 | 118.97 |
mp-16859 | -5.279438 | -6.893067 | 3.37197 | other | Ba12Ga10N2 | 24 | 167 | 769.66 |
mp-1191649 | -5.540648 | -2.913213 | 5.656048 | other | Ca2Si14Ir6 | 22 | 167 | 339.1 |
mp-1205332 | -4.681215 | -1.660008 | -2.394063 | other | Te12Rh2Br6 | 20 | 167 | 648.43 |
mp-1192829 | 1.283095 | 2.365359 | -5.956076 | other | Cs6Y4Cl18 | 28 | 167 | 915.31 |
mp-26048 | 12.91719 | 8.878309 | -5.562403 | other | Mo4P6O24 | 34 | 167 | 474.24 |
mp-5364 | 8.623626 | 7.311481 | -3.001063 | other | Yb2B2O6 | 10 | 167 | 126.12 |
mp-11034 | -8.177792 | -5.041284 | 4.284755 | other | Pr2Al14Au6 | 22 | 167 | 410.87 |
mp-16624 | -8.189319 | -5.040049 | 4.34018 | other | Er2Al14Au6 | 22 | 167 | 388.88 |
mp-569684 | 1.926528 | 2.637036 | -4.640699 | other | Zr6Te12Cl72 | 90 | 167 | 3,028.57 |
mp-19170 | 6.721588 | 11.382264 | 0.882404 | other | Pr2Ni2O6 | 10 | 167 | 110.65 |
mp-778408 | 7.397621 | 9.068115 | -1.259075 | other | Hg2Bi2O6 | 10 | 167 | 154.79 |
mp-1197677 | -7.038182 | 1.473086 | -4.223159 | other | Ba4Mo30Se38 | 72 | 167 | 1,662.64 |
mp-768883 | 10.388981 | 4.346248 | -7.227236 | other | Sn4S6O24 | 34 | 167 | 548.92 |
mp-733954 | 7.75842 | 9.345357 | -3.040078 | other | Ba6Ru6O30 | 42 | 167 | 701.34 |
mp-1188957 | -4.672766 | -1.629581 | -2.338191 | other | Te12Ir2Br6 | 20 | 167 | 648.46 |
mp-1029920 | 4.797286 | 2.035519 | -2.692323 | other | Y4C6N12 | 22 | 167 | 366.18 |
mp-642847 | 3.14056 | -0.643264 | -2.134614 | other | Li8H12Ru2 | 22 | 167 | 186.27 |
mp-26316 | 9.469745 | 8.059502 | -5.902698 | other | Cr4P6O24 | 34 | 167 | 455.05 |
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