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-1198418 | -3.081493 | -0.021514 | -2.92112 | other | Ta8Te32Cl32O8 | 80 | 14 | 2,521.75 |
mp-1203263 | 4.38979 | 2.986991 | -4.052298 | other | Sb4S32N24Cl20 | 80 | 14 | 1,944.29 |
mp-1044575 | 6.20674 | 9.581635 | -1.701872 | other | Ca4Ni4Bi4O20 | 32 | 14 | 494.26 |
mp-1101506 | 14.440356 | 8.430765 | -5.266698 | other | Li4Mo4P8O28 | 44 | 14 | 583.15 |
mp-863000 | 9.817865 | 1.895466 | -3.493977 | other | Sn2H12N4F8 | 26 | 14 | 259.46 |
mp-1199182 | -5.00805 | -2.962553 | -3.965218 | other | K8Cu16Sb8Se24 | 56 | 14 | 1,407.54 |
mp-1204679 | 7.996494 | 7.420856 | -4.491017 | other | As4S4N8O32 | 48 | 14 | 986.88 |
mp-1204380 | 7.562896 | 11.218029 | -0.677703 | other | K4Na8Ni8O16 | 36 | 14 | 537.99 |
mp-1212966 | 2.645272 | 2.271456 | 1.843836 | other | Er8Si16C4N24 | 52 | 14 | 610.72 |
mp-1203873 | 7.418787 | 6.875344 | -3.43549 | other | Ba4Mo4I16O60 | 84 | 14 | 1,425.3 |
mp-699535 | 2.257708 | 2.812626 | -4.410427 | other | Mo4S4Cl28O4 | 40 | 14 | 1,116.72 |
mp-1200107 | 10.156069 | 4.445994 | -6.640231 | other | K12H4S12O44 | 72 | 14 | 1,119.18 |
mp-1212994 | 8.94402 | 5.674542 | -6.506851 | other | Ho4Tl4S8O36 | 52 | 14 | 734.63 |
mp-27093 | 13.828976 | 6.847282 | -6.259131 | other | Li12Sn8P12O48 | 80 | 14 | 1,052.1 |
mp-1202588 | 8.498841 | 7.79436 | -4.855242 | other | Zn4Cu20P8O60 | 92 | 14 | 1,091.27 |
mp-558152 | 13.078438 | 6.367979 | -6.483002 | other | Gd4Ag4P16O48 | 72 | 14 | 969.4 |
mp-1195478 | 9.575266 | 3.440736 | -5.093724 | other | Ni6H36C12O36 | 90 | 14 | 783.24 |
mp-1043960 | 14.480001 | 8.051893 | -3.741975 | other | Mg4Ti4P8O28 | 44 | 14 | 514.67 |
mp-559758 | 10.730131 | 12.228605 | -3.332791 | other | Rb8Ca4V8O28 | 48 | 14 | 877.46 |
mp-560410 | 10.15688 | 9.636187 | 2.134746 | other | Sr4U2Ni2O12 | 20 | 14 | 279.95 |
mp-1202632 | 11.513182 | 7.155903 | 1.654866 | other | Tm16B4Cl4O28 | 52 | 14 | 711.77 |
mp-25993 | 11.421477 | 7.737176 | -7.775167 | other | Li12Fe8P12O48 | 80 | 14 | 924.21 |
mp-1188876 | 10.480639 | 9.121803 | 2.554502 | other | Sr4U2Cd2O12 | 20 | 14 | 309.35 |
mp-1181910 | 4.824582 | 2.934058 | -3.717506 | other | Cu8C16N4Cl20 | 48 | 14 | 1,158.52 |
mp-561538 | 10.75581 | 11.871356 | -3.090317 | other | Mg4V4Bi4O20 | 32 | 14 | 466.97 |
mp-752427 | 13.251761 | 5.342497 | -3.014461 | other | Li4Ni4B4O12 | 24 | 14 | 245.52 |
mp-766005 | 8.928752 | 3.468471 | -7.641041 | other | Li8V4C8O24 | 44 | 14 | 576.28 |
mp-15004 | 12.460403 | 6.449509 | -0.007048 | other | Ca12Zr4Si8O36 | 60 | 14 | 809.37 |
mp-768509 | 14.21985 | 5.004908 | -2.573765 | other | Li8Cr8B16O40 | 72 | 14 | 682.71 |
mp-1179913 | 8.360204 | 5.750971 | -5.683749 | other | Pr4Tl4S8O40 | 56 | 14 | 971.72 |
mp-560848 | -3.449534 | -1.633286 | -5.541487 | other | Ag4Sb4Pb4S12 | 24 | 14 | 602.85 |
mp-1209990 | 8.499862 | 10.818433 | 1.510511 | other | Nd4Ni2Ru2O12 | 20 | 14 | 246.53 |
mp-1047866 | 9.374657 | 0.485245 | 0.335969 | other | Ba4Mg4Co4F28 | 40 | 14 | 538.91 |
mp-672334 | 2.067003 | 1.863952 | 1.27661 | other | Sr16Ga4C4N20 | 44 | 14 | 754.72 |
mp-1177531 | 14.600708 | 8.242269 | -6.901407 | other | Li24V8P16O64 | 112 | 14 | 1,269.89 |
mp-555237 | 11.474197 | 4.079139 | -7.427393 | other | Pr4S4Cl4O16 | 28 | 14 | 437.87 |
mp-561083 | 13.019845 | 5.666719 | -6.165165 | other | Na24Bi8P16O64 | 112 | 14 | 1,439.08 |
mp-1212487 | 10.00808 | 10.011264 | 1.816266 | other | La28V8B4O68 | 108 | 14 | 1,672.04 |
mp-1204278 | 13.019116 | 6.481005 | -6.434157 | other | Rb8U12P24O100 | 144 | 14 | 2,294.31 |
mp-757884 | 14.063423 | 7.138211 | -5.277881 | other | Li4Sn6P8O28 | 46 | 14 | 695.09 |
mp-32396 | 9.734684 | 7.850082 | -6.184668 | other | Li4Ni4P8O28 | 44 | 14 | 543.57 |
mp-1214115 | 10.408747 | 11.116401 | 2.676013 | other | Ca8Nb4Cr4O24 | 40 | 14 | 477.67 |
mp-704545 | 6.070385 | 3.549572 | -4.679255 | other | Fe12C40Se4O40 | 96 | 14 | 1,507.2 |
mp-1213353 | 10.269079 | 4.641362 | -5.276514 | other | Fe4H16S4O16 | 40 | 14 | 588.89 |
mp-1202862 | 5.895714 | 4.222096 | -4.221212 | other | Co4S12N12O8 | 36 | 14 | 732.48 |
mp-571662 | -4.101189 | -2.450957 | -3.21202 | other | K4La4P8Se24 | 40 | 14 | 1,138.29 |
mp-505731 | 13.171614 | 6.033479 | -6.18311 | other | Ba8Co4P8O32 | 52 | 14 | 792.68 |
mp-1202752 | 6.709603 | 6.520894 | -3.915994 | other | C8N8Cl8O32 | 56 | 14 | 1,147.88 |
mp-697922 | 9.549582 | 1.924427 | -3.597503 | other | Sc2H16N6F12 | 36 | 14 | 403.92 |
mp-696225 | 11.779613 | 4.71159 | -4.819617 | other | K12P8H28O40 | 88 | 14 | 1,107.03 |
mp-1208392 | 13.952093 | 4.256417 | -2.201023 | other | Tb4Mg4B20O40 | 68 | 14 | 621.47 |
mp-1205421 | 2.259318 | 2.619128 | -4.338894 | other | Zr4S4Cl24O4 | 36 | 14 | 1,068.25 |
mp-561535 | 14.008086 | 5.144135 | -6.888486 | other | Na4Lu4P8O28 | 44 | 14 | 589.16 |
mp-1209013 | 9.286982 | 9.9452 | 3.267876 | other | Sr4Eu2Ta2O12 | 20 | 14 | 299.92 |
mp-1105266 | 7.561495 | 8.907561 | 0.319506 | other | Sr4Yb2Ta2O12 | 20 | 14 | 290.02 |
mp-1215141 | 8.350521 | 2.376313 | -1.006186 | other | Be4Ni2N4F28 | 38 | 14 | 617.18 |
mp-866688 | -4.419473 | -2.677571 | -3.442613 | other | Cs8P4Pd2Se16 | 30 | 14 | 1,105.72 |
mp-1209236 | 9.959334 | 11.039812 | -2.997091 | other | Rb4Yb4W8O32 | 48 | 14 | 766.45 |
mp-1213060 | 11.946945 | 7.230979 | -0.271663 | other | Dy4Al4Ge8O28 | 44 | 14 | 530.43 |
mp-721692 | 11.721378 | 4.688829 | -5.02605 | other | Mn2P4H16O20 | 42 | 14 | 411.87 |
mp-622273 | -0.864918 | 1.034104 | -4.830017 | other | Sn4Hg8S8Br8 | 28 | 14 | 1,283.06 |
mp-727198 | 10.004269 | 10.804 | -3.928268 | other | Li4Cd4Mo4O20 | 32 | 14 | 451.47 |
mp-1180913 | 6.774726 | 6.156115 | -4.038751 | other | Mg2Se4N4O28 | 38 | 14 | 728.09 |
mp-728374 | 9.9777 | 4.527462 | -4.919089 | other | Mn4H20S4O28 | 56 | 14 | 560.36 |
mp-24088 | 10.09464 | 3.23966 | -3.943125 | other | Ni4H32Cl8O16 | 60 | 14 | 603.17 |
mp-25839 | 14.745584 | 7.762852 | -4.682398 | other | Li12Ti8P12O48 | 80 | 14 | 948.74 |
mp-559509 | 8.136218 | 2.046707 | -0.547089 | other | Hg4Sb12Xe4F68 | 88 | 14 | 1,633.96 |
mp-1201924 | 8.131648 | 6.361879 | -5.296658 | other | Rb4Yb4S8O36 | 52 | 14 | 826.85 |
mp-1195291 | -3.892672 | -1.53089 | -5.421023 | other | Rb8Cu8Sb8S20 | 44 | 14 | 1,155.37 |
mp-1198941 | 12.42031 | 7.371416 | -7.034141 | other | K4Ni12P12O44 | 72 | 14 | 837.58 |
mp-1040927 | 10.580498 | 12.090733 | 2.248175 | other | Mg4Ta8Cu8O32 | 52 | 14 | 703.02 |
mp-1049181 | 7.606338 | 2.84595 | -4.615651 | other | Sn4H8C16O12 | 40 | 14 | 584.51 |
mp-1198276 | -3.488392 | -1.484317 | -5.321696 | other | Ag16Sb48Pb16S96 | 176 | 14 | 4,458.17 |
mp-757472 | 11.593633 | 8.002759 | -8.227642 | other | Li14Mn14P16O68 | 112 | 14 | 1,548.68 |
mp-634378 | 10.119107 | 4.430979 | -6.022291 | other | Na4H4S4O16 | 28 | 14 | 345.55 |
mp-1220573 | 8.371239 | 11.06254 | 2.178259 | other | Nd4Mn2Ga2O12 | 20 | 14 | 245.96 |
mp-567060 | 0.430436 | 1.604015 | -4.313199 | other | Al4Se4Br12N4 | 24 | 14 | 794.6 |
mp-6571 | 11.361367 | 7.500573 | -4.056644 | other | Ba4Cu4As8O28 | 44 | 14 | 677.45 |
mp-555592 | -2.593466 | -0.451439 | -5.091711 | other | Cs16Ta16P16S96 | 144 | 14 | 4,239.82 |
mp-1019604 | 10.496335 | 4.30583 | -6.78596 | other | Cs8B8S12O52 | 80 | 14 | 1,300.15 |
mp-1189105 | 9.881318 | 12.75007 | -0.590864 | other | Mn4Fe2Sb2O12 | 20 | 14 | 225.13 |
mp-559917 | 3.30389 | 2.937705 | -4.310255 | other | P32N16Cl80O16 | 144 | 14 | 4,011.29 |
mp-559838 | 11.585445 | 11.295826 | -3.943675 | other | Ho4Mo4O16F4 | 28 | 14 | 401.53 |
mp-1212005 | 11.369448 | 11.133839 | -2.368254 | other | K12Li12W12O48 | 84 | 14 | 1,504.06 |
mp-559212 | 10.259497 | 10.721159 | -3.531668 | other | Rb4Re4S4O12 | 24 | 14 | 571.57 |
mp-1199979 | 6.453096 | 0.756392 | -3.781496 | other | Mg2B24H24O12 | 62 | 14 | 837.59 |
mp-684497 | 12.602023 | 6.636611 | -6.683157 | other | Li4Bi4P16O48 | 72 | 14 | 944.57 |
mp-1041089 | 9.986777 | 9.625872 | -2.140193 | other | Ca4Cu8Te8O32 | 52 | 14 | 781.94 |
mp-1101538 | 11.144317 | 7.947918 | -7.482481 | other | Li4Mn4P20O60 | 88 | 14 | 1,251.34 |
mp-1197454 | 10.747699 | 3.095397 | -4.547958 | other | P16H64N16O48 | 144 | 14 | 1,482.17 |
mp-1196768 | 9.342221 | 7.567845 | -4.546853 | other | Ca4Be4As4O20 | 32 | 14 | 403.22 |
mp-22355 | 9.441688 | 9.386269 | 1.367732 | original | Sr4In2Sb2O12 | 20 | 14 | 278.01 |
mp-1105402 | 10.727206 | 10.694707 | 1.547746 | other | Sr4Dy2Mo2O12 | 20 | 14 | 287.28 |
mp-1201394 | 8.298742 | 1.133479 | -3.905026 | other | K8Zn4H32N16 | 60 | 14 | 731.39 |
mp-1179297 | 5.245293 | 2.771017 | -3.490485 | other | Si8Sb4C28Cl8 | 48 | 14 | 943.94 |
mp-1204059 | 12.259992 | 7.35813 | -6.821545 | other | Fe12Ag28P32O112 | 184 | 14 | 2,358.41 |
mp-559281 | -2.576238 | -0.227531 | -5.42845 | other | Na12Cr8P12S48 | 80 | 14 | 1,975.48 |
mp-640747 | 9.471886 | 11.018369 | 2.570832 | other | Sr12Nb8Co4O36 | 60 | 14 | 956.75 |
mp-558295 | 5.42751 | 2.81284 | -3.817805 | other | C4S12N20Cl4 | 40 | 14 | 784.07 |
mp-1019736 | 12.118393 | 6.676672 | -7.003942 | other | Cs4Eu4P16O48 | 72 | 14 | 1,065.17 |
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