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-31872 | 11.840899 | 7.904985 | -7.605976 | other | Fe10P12O44 | 66 | 14 | 863.81 |
mp-540558 | 5.961811 | 3.523784 | -4.081524 | other | S20N16O12 | 48 | 14 | 909.38 |
mp-604209 | 8.367052 | 1.330458 | -4.056639 | other | H48S8N16 | 72 | 14 | 900.49 |
mp-1199531 | 0.800981 | 1.274443 | -4.102567 | other | Gd20C8Cl36 | 64 | 14 | 1,719.66 |
mp-26750 | 9.292933 | 8.021915 | -5.59484 | other | Fe4P8O28 | 40 | 14 | 520.7 |
mp-1199525 | 13.005964 | 7.176996 | -5.76922 | other | U4P16O48 | 68 | 14 | 1,173.82 |
mp-677245 | -4.717465 | -5.497106 | 0.597706 | other | Na8Sr12As16 | 36 | 14 | 1,047.21 |
mp-31259 | 7.497463 | 6.513042 | -2.968682 | other | Bi4I12O36 | 52 | 14 | 798.9 |
mp-772063 | 1.10812 | 1.753138 | -5.24142 | other | Ba8La8Cl40 | 56 | 14 | 1,843.13 |
mp-558040 | 10.747291 | 10.924543 | -3.811332 | other | Cu8Mo8O32 | 48 | 14 | 677.16 |
mp-505465 | 11.165578 | 7.716892 | -2.680026 | other | As8Pb8O20 | 36 | 14 | 634.67 |
mp-731882 | 5.930972 | 5.461389 | -4.16714 | other | Sn4Cl12O16 | 32 | 14 | 842.91 |
mp-1203522 | 1.42823 | 2.745987 | -6.040266 | other | Cs16Hg8Cl32 | 56 | 14 | 2,034.3 |
mp-1180814 | 6.635985 | 6.051005 | -3.709064 | other | Lu4Br12O32 | 48 | 14 | 917.66 |
mp-1041470 | 7.7592 | 10.029744 | -3.808033 | other | Cr8Cu8O32 | 48 | 14 | 648.57 |
mp-1197980 | 8.932385 | 1.395814 | 1.02242 | other | Cr4Pb8F28 | 40 | 14 | 580.46 |
mp-1213748 | 7.546124 | 5.872363 | -3.531622 | other | Cs8W4O32 | 44 | 14 | 860.29 |
mp-1237084 | 7.678488 | 9.034983 | -1.949735 | other | Yb4Sb4O16 | 24 | 14 | 313.95 |
mp-558706 | -3.899577 | -1.384686 | -5.733516 | other | Rb4Ga12S20 | 36 | 14 | 924.97 |
mp-850331 | 10.002533 | 2.647253 | 2.141998 | other | Li8V4F16 | 28 | 14 | 323.94 |
mp-28668 | 6.457976 | 0.654332 | -3.472379 | other | B36H44N16 | 96 | 14 | 1,037.97 |
mp-1214990 | 7.314546 | 5.044597 | -5.129337 | other | Ba4C8O24 | 36 | 14 | 599.72 |
mp-8993 | 10.296169 | 7.560816 | 2.930956 | other | Sm8S8O4 | 20 | 14 | 413.03 |
mp-11790 | -4.393751 | -3.832112 | -3.930604 | other | La4Cu4Se8 | 16 | 14 | 373.31 |
mp-727413 | 7.528293 | 6.582299 | -3.011038 | other | K8I16O48 | 72 | 14 | 1,261.99 |
mp-754663 | 12.023478 | 6.092349 | -1.731103 | other | Na4Be4O6 | 14 | 14 | 129.51 |
mp-1191752 | 8.59631 | 8.026352 | -2.834536 | other | Ba4Te4O16 | 24 | 14 | 449.02 |
mp-1201110 | 10.362159 | 10.116217 | -1.54168 | other | Pb12W4O24 | 40 | 14 | 752.09 |
mp-757076 | 12.927026 | 6.189962 | -6.989209 | other | Sn4P8O28 | 40 | 14 | 546.01 |
mp-1209058 | -0.077093 | 0.662001 | -3.325876 | other | Sm8Tl4Br20 | 32 | 14 | 962.11 |
mp-1209423 | -1.265372 | 2.071429 | -1.737646 | other | Rb4Ba8I20 | 32 | 14 | 1,474.32 |
mp-778513 | 9.907458 | 0.814341 | 0.278249 | other | Li4Fe4F16 | 24 | 14 | 343.15 |
mp-756139 | 6.789186 | 6.104215 | -3.276783 | other | Ag4Br4O16 | 24 | 14 | 375.34 |
mp-8516 | 10.001632 | 4.599655 | -6.442073 | other | Cd4S4O12 | 20 | 14 | 300.59 |
mp-3476 | 12.772968 | 6.494045 | -6.228221 | other | P16Pb8O48 | 72 | 14 | 1,016.47 |
mp-780534 | 6.460058 | 0.445673 | -3.493273 | other | Rb8B40H40 | 88 | 14 | 1,171.89 |
mp-683918 | 5.496778 | 2.337037 | -3.087943 | other | Rb12C24N36 | 72 | 14 | 1,205.68 |
mp-1207670 | 8.39702 | 1.481749 | -0.205967 | other | Yb4Sn4F28 | 36 | 14 | 573.52 |
mp-27776 | 1.054487 | 2.165243 | -5.349879 | original | Cd8As4Cl8 | 20 | 14 | 549.84 |
mp-734390 | 7.931684 | 2.248895 | -0.882714 | other | Bi4N4F16 | 24 | 14 | 408.47 |
mp-767553 | -5.508248 | -4.339366 | -2.15633 | other | Li28Sb8S4 | 40 | 14 | 780.85 |
mp-769347 | 10.680082 | 4.523917 | -6.58052 | other | Mg4S4O12 | 20 | 14 | 248.29 |
mp-1203744 | 12.38215 | 5.275515 | -2.632226 | other | B20Pb8O42 | 70 | 14 | 872.35 |
mp-28303 | -4.675369 | -2.977683 | -3.878815 | other | Na24Si8Se32 | 64 | 14 | 1,680.86 |
mp-776077 | 10.294962 | 1.753212 | 2.174922 | other | Li8Fe8F24 | 40 | 14 | 506 |
mp-1197536 | 6.264799 | 4.985641 | -4.672361 | other | Er4N12O36 | 52 | 14 | 665.33 |
mp-18195 | 11.947525 | 7.026761 | 0.684655 | other | Lu8Si4O20 | 32 | 14 | 379.08 |
mp-554711 | 3.766987 | 2.879309 | -4.210825 | other | C4S4Cl8 | 16 | 14 | 434.09 |
mp-1178989 | 6.468389 | 12.226002 | -1.394856 | other | Tl4Ni4O12 | 20 | 14 | 223.64 |
mp-849308 | 7.695074 | 9.799748 | -3.63745 | other | Cr4Ag4O16 | 24 | 14 | 333.65 |
mp-558192 | 13.261418 | 5.896737 | -6.61399 | other | Na8P8O24 | 40 | 14 | 505.43 |
mp-1273989 | 6.575335 | 11.229987 | 1.063516 | other | La4Co4O12 | 20 | 14 | 243.2 |
mp-1214248 | 5.219686 | 2.570098 | -3.494896 | other | C16N4Cl8 | 28 | 14 | 578.64 |
mp-1376964 | 9.977968 | 0.675989 | 0.278342 | other | Zn4Fe4F20 | 28 | 14 | 368.59 |
mp-1044227 | 9.992529 | 10.640998 | -3.39672 | other | Bi4W4O20 | 28 | 14 | 582.39 |
mp-1020027 | 12.95654 | 6.870091 | -7.241615 | other | Li16P8O28 | 52 | 14 | 588.82 |
mp-1191837 | 9.203698 | 5.064177 | -6.176098 | other | Cs4S4O16 | 24 | 14 | 472.89 |
mp-1042536 | 11.351156 | 11.184159 | -2.68714 | other | Co8W16O56 | 80 | 14 | 1,338.02 |
mp-772212 | 13.008431 | 10.568646 | 2.249961 | other | Li4Nb20O32 | 56 | 14 | 777.44 |
mp-557406 | 13.780396 | 4.142569 | -2.318116 | other | Na12B36O60 | 108 | 14 | 1,247.07 |
mp-1178284 | 5.229099 | 11.788516 | -2.384539 | other | Fe10O16F4 | 30 | 14 | 326.45 |
mp-754072 | 14.736403 | 12.251015 | -0.971126 | other | V4O4F4 | 12 | 14 | 121.48 |
mp-778589 | 9.93346 | 8.642744 | 2.482056 | other | Ba24Ce12O42 | 78 | 14 | 1,718.18 |
mp-31036 | -5.509105 | -2.848128 | -2.411832 | other | Cu4Te8Br4 | 16 | 14 | 486.89 |
mp-779463 | 13.563372 | 5.548144 | -6.889895 | other | Dy8P16O52 | 76 | 14 | 1,154.25 |
mp-1188982 | -5.672318 | -1.967432 | 4.430827 | other | Tm4Si8Mo6 | 18 | 14 | 294.74 |
mp-1179472 | 6.227755 | 5.365974 | -4.45414 | other | Th4N16O64 | 84 | 14 | 1,482.44 |
mp-1209135 | 6.648785 | 4.99981 | -4.691303 | other | S12N8O16 | 36 | 14 | 601.72 |
mp-1200382 | 7.521046 | 7.321609 | -4.156693 | other | Pr8Se12O64 | 84 | 14 | 1,443.56 |
mp-769023 | 1.221802 | 2.013146 | -5.269041 | other | Ba4Y14Cl50 | 68 | 14 | 2,754.35 |
mp-1192595 | -4.504821 | -3.295819 | -3.724882 | other | Ba8Sn4Se16 | 28 | 14 | 933.84 |
mp-779018 | 12.889023 | 0.863203 | 1.98665 | other | Fe6O4F8 | 18 | 14 | 219.26 |
mp-1102580 | -6.532747 | -3.052461 | 0.215432 | other | Fe4Sb4Te4 | 12 | 14 | 248.61 |
mp-1181214 | 9.206209 | 3.476827 | -5.222563 | other | H12C4O12 | 28 | 14 | 260.14 |
mp-14695 | 13.013318 | 10.487195 | -0.175445 | other | Sn4Mo20O32 | 56 | 14 | 839.17 |
mp-561700 | 13.087609 | 6.426982 | -6.778286 | other | La4P20O56 | 80 | 14 | 1,097.35 |
mp-28537 | 11.428977 | 7.837655 | -3.009719 | other | As8Pb4O16 | 28 | 14 | 480.87 |
mp-1327604 | 9.437022 | 0.707352 | -0.439224 | other | Mg4Ni4F20 | 28 | 14 | 332.66 |
mp-1205383 | 11.342753 | 7.649611 | 0.948506 | other | Nd8Ge4O20 | 32 | 14 | 463.88 |
mp-1103256 | -6.417338 | -2.448038 | 0.044564 | other | Fe4Sb4Se4 | 12 | 14 | 215.39 |
mp-540923 | -3.304804 | -4.636296 | 0.98711 | other | Ba12Sn4P12 | 28 | 14 | 911.32 |
mp-554874 | 11.238549 | 7.954204 | -1.670357 | other | Cu4Ge4O12 | 20 | 14 | 212.59 |
mp-1199792 | -2.993292 | -2.240814 | -5.914738 | other | Gd16Si12S48 | 76 | 14 | 1,783.17 |
mp-781622 | 11.348024 | 4.315663 | -3.353898 | other | Lu8H24O24 | 56 | 14 | 667.25 |
mp-776795 | -0.234646 | 0.757418 | -3.760472 | other | Ba4Y4Br20 | 28 | 14 | 1,082.56 |
mp-1192806 | 6.578407 | 4.437217 | -4.855303 | other | Cu2C8O16 | 26 | 14 | 541.55 |
mp-753748 | -4.241399 | -1.394252 | -5.653983 | other | Li12Cu4S8 | 24 | 14 | 405.77 |
mp-571523 | -0.401213 | 0.724915 | -2.540523 | other | La44C44Cl28 | 116 | 14 | 2,488.61 |
mp-28745 | -5.478751 | -2.090477 | -1.663803 | other | Nb8Te24I4 | 36 | 14 | 1,191.7 |
mp-1182399 | 6.36344 | 5.48275 | -4.295149 | other | Ca4N8O40 | 52 | 14 | 759.38 |
mp-558621 | 14.076787 | 4.617087 | -2.053592 | other | Ce4B12O24 | 40 | 14 | 360.01 |
mp-675232 | 11.34458 | 12.186903 | -1.179334 | other | Cr4H4O8 | 16 | 14 | 139.17 |
mp-1214794 | -5.772591 | -2.195419 | -0.692999 | other | As4Ru4Se4 | 12 | 14 | 212.12 |
mp-669476 | 1.108802 | 1.621475 | -5.153283 | other | Ba8Sc4Cl28 | 40 | 14 | 1,170.33 |
mp-566534 | 12.495837 | 6.916962 | -7.180879 | other | Eu4P20O56 | 80 | 14 | 1,013.66 |
mp-27722 | 3.996315 | 3.027404 | -4.364634 | other | Pd4S24N8 | 36 | 14 | 1,062.22 |
mp-1347935 | 8.49845 | 1.664365 | 0.844178 | other | Ca4Sb4F20 | 28 | 14 | 472.44 |
mp-28332 | -1.213296 | 2.96948 | -3.041095 | other | Cs4Tl4I16 | 24 | 14 | 1,268.9 |
mp-1209026 | 11.340307 | 10.957734 | -4.089477 | other | Sm4Mo4O20 | 28 | 14 | 442.08 |
mp-755984 | 8.415099 | 11.129898 | 0.082508 | other | Na12Mn4O12 | 28 | 14 | 399.89 |
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