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-684503 | 13.826646 | 7.058572 | -5.906749 | other | Li4Sn4P12O36 | 56 | 19 | 725.6 |
mp-1227400 | 13.139782 | 5.431387 | -5.273655 | other | Ca20Si4P8O48 | 80 | 19 | 1,078.07 |
mp-760193 | 7.754657 | 0.32397 | -4.482316 | other | H36Pb4C12I4 | 56 | 19 | 819.35 |
mp-13755 | 13.163975 | 5.938725 | -6.447227 | other | Ba4Na4P12O36 | 56 | 19 | 831.08 |
mp-643794 | 7.25096 | 5.583836 | -4.232326 | other | H4S4O12F4 | 24 | 19 | 458.05 |
mp-667447 | 8.064344 | 2.174987 | -1.149959 | other | Te8As8Se16F48 | 80 | 19 | 2,013.59 |
mp-1196592 | 7.335785 | 0.230429 | -4.135627 | other | Mg4B16H80N8 | 108 | 19 | 1,003.44 |
mp-761067 | 13.652876 | 7.211122 | -7.033213 | other | Na4Mn4P12O36 | 56 | 19 | 703.47 |
mp-1202654 | 6.778313 | 6.477612 | -3.915915 | other | Na4Cr4N4O24 | 36 | 19 | 606.9 |
mp-1213914 | 6.908789 | 6.028517 | -3.341996 | other | Cd4H8Br8O24 | 44 | 19 | 731.19 |
mp-761042 | 12.573879 | 7.124115 | -7.107314 | other | Na4Cu4P12O36 | 56 | 19 | 686.34 |
mp-556378 | 9.364944 | 7.440961 | -2.932427 | other | Bi4Se4Cl4O12 | 24 | 19 | 442.46 |
mp-1339646 | 9.643677 | 8.270328 | -4.443472 | other | Zn4Ni4As4O20 | 32 | 19 | 389.79 |
mp-774412 | 14.023893 | 7.125935 | -6.184368 | other | Li4Cr4P12O36 | 56 | 19 | 888.74 |
mp-1228850 | 8.214501 | 2.415381 | -1.078088 | other | As4Xe4O8F28 | 44 | 19 | 750.49 |
mp-554359 | 12.619293 | 6.250595 | -0.683049 | other | Cs8Si12Sn4O36 | 60 | 19 | 1,015.38 |
mp-1198468 | 9.998476 | 4.451889 | -7.177826 | other | Rb16Hf4S16O68 | 104 | 19 | 1,907.42 |
mp-622295 | 12.893662 | 8.412155 | -6.138385 | other | Na4Mo4P8O32 | 48 | 19 | 677.67 |
mp-1199691 | 7.337016 | 0.236042 | -4.135149 | other | Mg4B16H80N8 | 108 | 19 | 1,000.32 |
mp-1198051 | 10.862939 | 7.022695 | -1.471512 | other | K8Al8Si8O36 | 60 | 19 | 924.89 |
mp-1227191 | 12.311642 | 6.25348 | -5.641119 | other | Cd20Si4P8O48 | 80 | 19 | 1,070.88 |
mp-722865 | 9.875917 | 3.02228 | -4.391012 | other | H32Se8N8O20 | 68 | 19 | 722.27 |
mp-1213928 | 8.313668 | 1.642789 | -2.040494 | other | Cs8B48H16F36 | 108 | 19 | 1,550 |
mp-554216 | -2.513095 | -0.550282 | -5.336305 | other | K12Bi4P8S32 | 56 | 19 | 1,503.09 |
mp-1192887 | -3.329325 | -1.5835 | -5.628476 | other | Cs4Eu4Si4S16 | 28 | 19 | 800.55 |
mp-758307 | 14.71412 | 8.009464 | -5.641912 | other | Li4V4P12O36 | 56 | 19 | 666.09 |
mp-758377 | 14.673065 | 8.06295 | -5.530295 | other | Li4V4P12O36 | 56 | 19 | 692.77 |
mp-775165 | 8.262681 | 14.559632 | -1.091977 | other | Li8Mn12Cu4O32 | 56 | 19 | 567.72 |
mp-560156 | 11.103499 | 11.998735 | -2.866109 | other | Sr4Tl4V4O16 | 28 | 19 | 465.28 |
mp-1195080 | 8.080243 | 7.195241 | -4.669352 | other | Rb4V8P4O44 | 60 | 19 | 965.61 |
mp-15866 | 13.556143 | 8.807901 | -7.029681 | other | Sr4V12P16O68 | 100 | 19 | 1,288.86 |
mp-1194840 | 10.942827 | 11.109205 | -2.896851 | other | Na4As4W8O36 | 52 | 19 | 750.38 |
mp-1202697 | 7.404354 | 0.387411 | -4.168525 | other | Li8B8H48N8 | 72 | 19 | 621.87 |
mp-831244 | 13.377028 | 6.520185 | -0.798128 | other | Li8Mn4Si16O40 | 68 | 19 | 989.65 |
mp-734811 | -1.090788 | 2.704767 | -3.097369 | other | Rb8Cu8I16O4 | 36 | 19 | 1,247.11 |
mp-1344634 | 10.054599 | 7.960414 | -4.246842 | other | Ca4Ni4As4O20 | 32 | 19 | 391.22 |
mp-504179 | 14.168652 | 7.450187 | -6.394803 | other | Li4Fe4P12O36 | 56 | 19 | 652.97 |
mp-1020145 | 9.559776 | 4.80479 | -6.41815 | other | Na8Ge4S24O84 | 120 | 19 | 1,899.83 |
mp-555457 | 8.535685 | 2.66163 | -1.466625 | other | Te8S4O16F24 | 52 | 19 | 835.11 |
mp-1178832 | 7.226363 | 6.452711 | -4.412446 | other | Y4Ni4S4O28 | 40 | 19 | 646.14 |
mp-860885 | 12.604692 | 7.41847 | -7.155178 | other | Li4Ni4P12O36 | 56 | 19 | 678.85 |
mp-1238166 | 7.114071 | 0.781459 | -3.805737 | other | Ca4B48H96O32 | 180 | 19 | 1,817.59 |
mp-1195615 | 13.800441 | 4.103641 | -2.346843 | other | Na12B24Cl4O40 | 80 | 19 | 966.3 |
mp-1202649 | 8.217777 | 6.517356 | -4.273918 | other | H12Se8N4O24 | 48 | 19 | 780.87 |
mp-1359496 | 13.440351 | 8.966319 | -2.959523 | other | Mg4Mo4As4O20 | 32 | 19 | 466.51 |
mp-504967 | 11.768601 | 4.589558 | -4.728861 | other | Cr4P4H20O20 | 48 | 19 | 485.89 |
mp-1226125 | 12.864605 | 6.114054 | -0.875235 | other | Cs4Si8H4O20 | 36 | 19 | 604.68 |
mp-1358892 | 13.554463 | 8.172028 | -3.426604 | other | Ti4Zn4As4O20 | 32 | 19 | 421.26 |
mp-561259 | 8.815445 | 1.456236 | 1.083159 | other | Na12Nb4O4F24 | 44 | 19 | 578.4 |
mp-850197 | 13.834723 | 8.33672 | -7.219953 | other | Li8V4P8O32 | 52 | 19 | 668.47 |
mp-1177993 | 8.628037 | 15.228957 | -0.625752 | other | Li8Mn12Sn4O32 | 56 | 19 | 636.33 |
mp-19492 | 13.670659 | 7.32432 | -7.130566 | other | Li4Mn4P12O36 | 56 | 19 | 668.62 |
mp-721901 | 12.30703 | 4.138222 | -3.120609 | other | K8B16H32O44 | 100 | 19 | 1,071.17 |
mp-1195518 | 12.84843 | 6.253681 | -0.487051 | other | Na48Tm16Si48O144 | 256 | 19 | 3,527.24 |
mp-733508 | 9.853326 | 5.33102 | -4.230228 | other | Sm4H20Se8O32 | 64 | 19 | 869.38 |
mp-726434 | 8.669545 | 3.584717 | -4.76331 | other | Mo8H12C16O32 | 68 | 19 | 1,012.85 |
mp-773650 | 11.381608 | 13.621616 | -1.903437 | other | Li8V12Cu4O32 | 56 | 19 | 596.7 |
mp-1210124 | 8.820693 | 1.709666 | 1.506775 | other | Na4Sr4Ti4F24 | 36 | 19 | 555.6 |
mp-1663521 | 8.824306 | 13.103732 | -1.006277 | other | Li4Al4Cr4O16 | 28 | 19 | 274.54 |
mp-1200310 | 6.446249 | 5.421963 | -4.456058 | other | Hg4S8N8O24 | 44 | 19 | 1,060.64 |
mp-699478 | 10.009609 | 1.968568 | -3.67478 | other | Fe4H48N12F24 | 88 | 19 | 764 |
mp-1221015 | 10.907871 | 9.219072 | -4.465454 | other | Na4Mo4As4O24 | 36 | 19 | 520.07 |
mp-558477 | 13.286007 | 7.777586 | -6.622494 | other | Ba12V8P12O60 | 92 | 19 | 1,392.8 |
mp-679971 | 2.380299 | 2.481815 | -4.578161 | other | Ti4Si16N8Cl56 | 84 | 19 | 2,422.74 |
mp-1358311 | 10.992508 | 8.052049 | -5.040827 | other | Mn4Zn4As4O20 | 32 | 19 | 429.83 |
mp-1205250 | 9.321487 | 5.089997 | -4.240805 | other | Cu4H20I4O28 | 56 | 19 | 557.54 |
mp-757042 | 13.962765 | 7.057394 | -5.421561 | other | Li4Sn4P4O16 | 28 | 19 | 428.87 |
mp-1047032 | 11.400916 | 7.556706 | -3.703464 | other | Zn4Bi4As4O20 | 32 | 19 | 530.93 |
mp-1197678 | 9.839137 | 11.72522 | -3.779521 | other | V8Cu16H8O40 | 72 | 19 | 808.54 |
mp-1197496 | 1.849954 | 2.38248 | -3.630162 | other | Cu8I16N8O4 | 36 | 19 | 1,018.83 |
mp-1214254 | 5.085377 | 3.165286 | -4.006477 | other | C4S8N8O4 | 24 | 19 | 568.84 |
mp-558221 | 10.801903 | 12.192985 | -3.555309 | other | Ba8V16Cd12O60 | 96 | 19 | 1,482.8 |
mp-1197024 | 9.276014 | 7.138048 | -3.441621 | other | Fe4Bi4Se12O36 | 56 | 19 | 889.97 |
mp-1219620 | 8.003369 | 8.986239 | -3.287629 | other | Rb4Os4N4O12 | 24 | 19 | 495.71 |
mp-726725 | 2.264977 | 3.190752 | -4.619105 | other | K4Zn4Cl12O4 | 24 | 19 | 626.8 |
mp-505139 | 10.502715 | 4.502754 | -5.972011 | other | Ti4H8S4O24 | 40 | 19 | 452.8 |
mp-642578 | 6.840752 | 6.10022 | -4.346725 | other | K8Mn8S12O48 | 76 | 19 | 1,657 |
mp-1193881 | 5.724408 | 5.224616 | -3.967179 | other | K4Zn4Br12O8 | 28 | 19 | 891.77 |
mp-1192743 | 11.61184 | 7.366343 | -0.780114 | other | Sr4Ge4Pb4O16 | 28 | 19 | 453.12 |
mp-556463 | 12.541753 | 5.858186 | -1.435431 | other | K4Ge8B4O24 | 40 | 19 | 547.08 |
mp-26225 | 14.730314 | 8.044581 | -5.530609 | other | Li4V4P12O36 | 56 | 19 | 650.32 |
mp-24574 | 10.043496 | 5.365772 | -4.202711 | other | Nd4H20Se8O32 | 64 | 19 | 809.99 |
mp-1201317 | 8.749706 | 11.117376 | -3.599461 | other | Li4V4Cu8O24 | 40 | 19 | 483.45 |
mp-560639 | 7.87312 | 2.346653 | -1.30598 | other | Sb4S4Br12F24 | 44 | 19 | 937.12 |
mp-604120 | 10.834096 | 3.331112 | -4.470149 | other | P4H24N4O16 | 48 | 19 | 472.69 |
mp-1194785 | 13.092697 | 5.943569 | -5.813214 | other | Ba12P12Br4O40 | 68 | 19 | 1,198.38 |
mp-1665344 | 12.714936 | 7.321567 | -7.274113 | other | Li4Ni4P4O16 | 28 | 19 | 284.82 |
mp-1264368 | 12.893046 | 6.461792 | -1.007981 | other | Li8Co4Si16O40 | 68 | 19 | 969.57 |
mp-24396 | 10.601579 | 3.895429 | -4.315969 | other | Mg4H56S4O44 | 108 | 19 | 985.95 |
mp-771408 | 10.999047 | 2.574853 | 0.957868 | other | Li8V8O8F24 | 48 | 19 | 589.86 |
mp-1196335 | 7.585924 | 5.342531 | -3.567051 | other | Pr4H16Cl12O44 | 76 | 19 | 1,019.99 |
mp-16934 | 9.806049 | 8.565972 | 2.750823 | other | Ba4La4Al4O16 | 28 | 19 | 428.66 |
mp-728878 | 5.601358 | 3.257535 | -4.68303 | other | B4Ru24C68O68 | 164 | 19 | 2,704.85 |
mp-23844 | 11.277985 | 7.309456 | -3.648983 | other | Hg4H4O4F4 | 16 | 19 | 218.88 |
mp-766274 | 8.233808 | 4.30138 | -4.71912 | other | Cu8H12N4O24 | 48 | 19 | 478.86 |
mp-1213751 | 8.373844 | 1.909591 | -1.814881 | other | Cs8B48H4F48 | 108 | 19 | 1,621.04 |
mp-561635 | -3.296245 | -1.779386 | -5.698568 | other | Cs4Sm4Si4S16 | 28 | 19 | 780.18 |
mp-555266 | 9.868514 | 4.556089 | -7.029224 | other | Na8V4S8O36 | 56 | 19 | 747.96 |
mp-1201035 | 6.057073 | 5.388666 | -4.397294 | other | K4Co4N24O32 | 64 | 19 | 1,020.66 |
mp-1197739 | 10.52939 | 3.874848 | -4.32552 | other | Zn4H56S4O44 | 108 | 19 | 991.99 |
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