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-28842 | 3.746873 | -0.717146 | -2.565588 | other | Si12P4H36 | 52 | 14 | 769.14 |
mp-1024067 | -3.805902 | -1.66082 | -5.729797 | other | Na8Zn4S8 | 20 | 14 | 419.8 |
mp-30109 | 8.420445 | 2.037693 | -0.808824 | other | Sb4Au6F36 | 46 | 14 | 661.97 |
mp-1980701 | 9.884106 | 12.710226 | -0.888115 | other | Hf4Cr4O16 | 24 | 14 | 270.81 |
mp-1224893 | -5.603172 | -0.696598 | -3.957423 | other | Fe2Ni2S8 | 12 | 14 | 167.52 |
mp-559436 | 14.421126 | 5.346537 | -2.151647 | other | Fe8B16O32 | 56 | 14 | 474.01 |
mp-1190405 | 9.005117 | 6.75611 | -3.912666 | other | Ca4Se4O16 | 24 | 14 | 350.69 |
mp-1236914 | 14.685738 | 8.225437 | -5.039103 | other | Cr6P4O16 | 26 | 14 | 324.98 |
mp-779338 | 10.898282 | 8.223458 | -7.809155 | other | Mn16P24O84 | 124 | 14 | 1,581.39 |
mp-655140 | 6.794529 | 6.697164 | -3.478537 | other | Mn4Ag4O16 | 24 | 14 | 379.98 |
mp-28943 | 14.184739 | 6.198252 | -3.006308 | other | Mn8B4O16 | 28 | 14 | 285.67 |
mp-684496 | 10.851398 | 7.760702 | -6.828457 | other | Sb4P8O28 | 40 | 14 | 540.16 |
mp-32363 | 8.64442 | 7.927802 | -4.989121 | other | Ni4P8O28 | 40 | 14 | 525.7 |
mp-1245718 | 1.12549 | 1.886668 | 2.405893 | other | Nb20Co4N36 | 60 | 14 | 671.38 |
mp-1201330 | -5.582554 | -2.177987 | -2.187623 | other | Te48Mo8I24 | 80 | 14 | 3,206.58 |
mp-1372734 | 9.296473 | 1.13908 | 1.108493 | other | Ca4Cr4F20 | 28 | 14 | 388.24 |
mp-571314 | 1.477059 | 2.575631 | -5.831809 | other | K8Co4Cl16 | 28 | 14 | 786.3 |
mp-25896 | 12.851924 | 7.166126 | -6.557165 | other | Sb4P8O28 | 40 | 14 | 529.58 |
mp-1100384 | -3.61867 | -1.304671 | -5.673055 | other | Ca4Sn20S44 | 68 | 14 | 1,665.03 |
mp-690493 | 12.888268 | 11.303163 | 0.071828 | other | Li4Mo4O8 | 16 | 14 | 170.18 |
mp-1205014 | 7.90953 | 7.47362 | -4.045846 | other | Pu8I4O40 | 52 | 14 | 869.83 |
mp-1195093 | -4.794558 | -5.380181 | 0.531686 | other | Sr12Sn8As16 | 36 | 14 | 1,080.09 |
mp-557795 | 8.122093 | 11.874505 | 1.935298 | other | La4Mn4O12 | 20 | 14 | 297.14 |
mp-779147 | 13.731403 | 5.543245 | -6.894101 | other | Ho8P16O52 | 76 | 14 | 1,155.49 |
mp-22814 | -5.2996 | -3.18667 | 4.786969 | other | U4Ti6Si8 | 18 | 14 | 306.9 |
mp-27394 | 1.394067 | 2.642938 | -5.890683 | other | Cs4Sn4Cl12 | 20 | 14 | 707.75 |
mp-754770 | 10.386944 | 0.860872 | 1.642104 | other | Li4Mn4F12 | 20 | 14 | 269.78 |
mp-1197843 | 10.105366 | 7.188559 | -1.521849 | other | Ca10Si4O20 | 34 | 14 | 502.2 |
mp-780422 | 11.245478 | 7.995188 | 1.895803 | other | La12Al12O36 | 60 | 14 | 942.81 |
mp-553958 | 12.817038 | 5.986449 | -6.281135 | other | Zn12P8O32 | 52 | 14 | 636.69 |
mp-1203167 | 5.739717 | 3.256691 | -4.015485 | other | C24S32O8 | 64 | 14 | 1,289.69 |
mp-764814 | 12.097209 | 7.591163 | -6.835229 | other | Ni36P24O96 | 156 | 14 | 1,732.42 |
mp-768288 | -4.468027 | -0.95984 | -5.504413 | other | Li12Fe4S12 | 28 | 14 | 507.42 |
mp-756725 | -1.249691 | 1.914627 | -1.577382 | other | Ba4Ca2I12 | 18 | 14 | 792.49 |
mp-1237008 | 9.971477 | 9.450483 | 1.016699 | other | Er4Sb4O16 | 24 | 14 | 293.43 |
mp-1042755 | 11.479474 | 9.642632 | -2.923345 | other | As8W4O28 | 40 | 14 | 712.09 |
mp-558373 | 10.706986 | 11.621492 | 3.11067 | other | Pr4Nb12O36 | 52 | 14 | 701.62 |
mp-15046 | -3.964303 | -2.480156 | -3.457847 | other | Sb8P12Se36 | 56 | 14 | 1,565.7 |
mp-780638 | 10.306099 | 1.888525 | 2.165535 | other | Li8Fe12F32 | 52 | 14 | 679.6 |
mp-1213774 | 7.547394 | 5.946505 | -3.42836 | other | Cs8Mo4O32 | 44 | 14 | 851.09 |
mp-1029595 | 1.464369 | 2.196389 | 1.014655 | other | Na12Os4N8 | 24 | 14 | 419.09 |
mp-1259818 | 8.294524 | 13.15851 | -0.986982 | other | Al4Fe4O12 | 20 | 14 | 197.91 |
mp-752648 | 8.278665 | 8.675219 | 0.676354 | other | Ba6Br4O4 | 14 | 14 | 446.95 |
mp-570505 | 2.287733 | 1.914712 | 1.60071 | other | Ca12Al8N16 | 36 | 14 | 489.73 |
mp-28589 | -0.376516 | 1.261419 | -4.654779 | other | Rb12Ge8Br28 | 48 | 14 | 1,794.14 |
mp-770695 | 7.948126 | 8.448889 | -0.224813 | other | Rb12Pb4O12 | 28 | 14 | 705.09 |
mp-752496 | 12.754545 | 10.81024 | 1.801783 | other | Ti4O4F4 | 12 | 14 | 129.53 |
mp-624200 | -2.682353 | 0.683821 | -3.549779 | other | Re12Se16Br4 | 32 | 14 | 840.69 |
mp-27688 | -1.169148 | 2.939275 | -2.912293 | other | K4Te2I12 | 18 | 14 | 782.66 |
mp-1195068 | -4.609565 | -2.807197 | -3.403124 | other | Ba12Ta8Se36 | 56 | 14 | 1,661.73 |
mp-556291 | -3.250022 | -1.751428 | -5.444991 | other | Ba12Sn8S28 | 48 | 14 | 1,429.02 |
mp-767002 | 12.18751 | 12.204759 | 1.740517 | other | Ti20P4O44 | 68 | 14 | 813.38 |
mp-30995 | 10.162063 | 9.500729 | -2.098933 | other | Fe8Te16O44 | 68 | 14 | 1,018.83 |
mp-772056 | 6.175872 | 10.681638 | -1.453941 | other | Mg8Fe4O16 | 28 | 14 | 297.89 |
mp-770446 | 11.790494 | 7.085992 | -4.192186 | other | Mg12As8O32 | 52 | 14 | 658.59 |
mp-753041 | 10.272299 | 0.190508 | 0.39984 | other | Li6Mn2F12 | 20 | 14 | 207.93 |
mp-1190301 | 2.948086 | 3.23619 | -4.088859 | other | Ba4Cl8O8 | 20 | 14 | 460.25 |
mp-1043650 | 10.050282 | 10.548875 | -3.290624 | other | Re4Bi4O20 | 28 | 14 | 643.73 |
mp-1204155 | 13.078953 | 8.196219 | -6.701672 | other | Fe12P8O36 | 56 | 14 | 693.79 |
mp-771882 | 10.573891 | 11.565307 | -3.892193 | other | Nb8V8O40 | 56 | 14 | 951.25 |
mp-1211092 | 6.832142 | 5.699133 | -4.403251 | other | Mo4N8O16 | 28 | 14 | 429.01 |
mp-1225004 | -5.645953 | -0.674751 | -3.940955 | other | Fe2Co2S8 | 12 | 14 | 162.39 |
mp-557880 | 13.104959 | 5.926926 | -6.305082 | other | K12P12O36 | 60 | 14 | 1,005.76 |
mp-15433 | -5.112934 | -5.966318 | 0.365586 | other | K16Ga16Sb24 | 56 | 14 | 1,799.22 |
mp-4252 | -2.491595 | -0.576211 | -5.416876 | other | Sn4P4S12 | 20 | 14 | 484.47 |
mp-29958 | 11.030918 | 7.767929 | -3.630154 | other | Hg14P4O20 | 38 | 14 | 614.09 |
mp-1189145 | -5.659221 | -2.021058 | 4.346305 | other | Dy4Si8Mo6 | 18 | 14 | 300.71 |
mp-1211665 | 8.23569 | 0.923876 | 1.753737 | other | K6Lu2F12 | 20 | 14 | 356.17 |
mp-1213078 | 9.77247 | 10.991606 | -3.096678 | other | Er4W4O20 | 28 | 14 | 412.4 |
mp-753662 | 12.99994 | 8.753222 | 4.292714 | other | K4Mg4O6 | 14 | 14 | 209.89 |
mp-764333 | 14.489957 | 12.123652 | -0.803925 | other | V6O4F12 | 22 | 14 | 272 |
mp-1378417 | 10.456416 | 0.280419 | 0.306099 | other | Mn4Zn4F20 | 28 | 14 | 364.23 |
mp-777673 | 10.319775 | 1.525769 | 2.055997 | other | Li8Fe4F16 | 28 | 14 | 334.91 |
mp-1190564 | 12.061893 | 6.501549 | -5.428775 | other | Bi4P4O16 | 24 | 14 | 293.96 |
mp-562735 | 8.541848 | 8.820697 | -0.223806 | other | Cs20Fe4O16 | 40 | 14 | 1,052.25 |
mp-725918 | 7.489964 | 6.529418 | -4.554949 | other | S4N4O16 | 24 | 14 | 443.53 |
mp-1097002 | -4.482431 | -2.263084 | -3.471311 | other | Hf2Te4Se12 | 18 | 14 | 594.84 |
mp-29370 | -3.438759 | -4.531381 | 0.874659 | other | Na12B4P8 | 24 | 14 | 558.09 |
mp-29264 | 2.025036 | 2.807527 | -4.401414 | other | S4I4Cl28 | 36 | 14 | 1,054.8 |
mp-28890 | 8.447035 | 9.975977 | 0.089446 | other | K8Co4O8 | 20 | 14 | 397.44 |
mp-1221539 | 1.746896 | 2.137282 | -3.96255 | other | Mo4Br12O4 | 20 | 14 | 540.97 |
mp-505603 | 10.213332 | 7.870363 | -2.074492 | other | Pb20S4O32 | 56 | 14 | 1,006.59 |
mp-637235 | 4.641006 | 2.243243 | -3.046948 | other | K4C8N12 | 24 | 14 | 433.27 |
mp-1193645 | 8.409704 | 9.460461 | -3.82206 | other | Li4Re4O20 | 28 | 14 | 454.86 |
mp-684502 | 13.578899 | 6.829493 | -6.098706 | other | Sn8P12O40 | 60 | 14 | 964.95 |
mp-1043603 | 8.30645 | 8.46546 | -3.437171 | other | Bi4Te4O20 | 28 | 14 | 567.66 |
mp-1195034 | -1.216589 | 2.734009 | -2.800337 | other | Rb12Bi8I36 | 56 | 14 | 2,743.75 |
mp-555759 | 10.34845 | 10.176179 | -3.139439 | other | Re4Hg10O20 | 34 | 14 | 608.01 |
mp-1214099 | 3.39234 | -0.751124 | -2.4039 | other | Ca2Al4H16 | 22 | 14 | 217.84 |
mp-1079331 | 3.071884 | 3.103192 | -4.069025 | other | Pt2N4Cl4 | 10 | 14 | 223.31 |
mp-780420 | 10.905974 | 8.343143 | 2.48686 | other | Lu16Al8O36 | 60 | 14 | 784.23 |
mp-616458 | 8.554502 | 3.860378 | -6.920052 | other | Cs8C4O12 | 24 | 14 | 508.45 |
mp-1343674 | 9.635413 | 0.532401 | -0.295824 | other | Mg4Co4F20 | 28 | 14 | 344.09 |
mp-1178551 | 8.358175 | 9.034038 | 0.595722 | other | Ba6Cl4O4 | 14 | 14 | 423.27 |
mp-3584 | 13.576648 | 5.29583 | -6.220312 | other | Nd4P4O16 | 24 | 14 | 293.09 |
mp-5733 | 12.689284 | 6.366865 | -0.407331 | other | Ca12Si12O36 | 60 | 14 | 797.33 |
mp-1331355 | 8.495792 | 8.119403 | -4.459167 | other | Fe6As8O32 | 46 | 14 | 687.89 |
mp-18315 | 10.228868 | 7.986529 | -0.302022 | other | Cs12Si4O14 | 30 | 14 | 663.1 |
mp-1227095 | 8.746823 | 1.049888 | 0.698698 | other | Ca2Pd2F8 | 12 | 14 | 169.67 |
mp-1210441 | -0.208726 | 0.963582 | -4.184089 | other | Na6Lu2Br12 | 20 | 14 | 576.54 |
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