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-559949 | 13.712977 | 4.783205 | -2.333895 | other | Zn12B8O24 | 44 | 9 | 514.91 |
mp-753296 | 5.922674 | 13.060012 | -1.456063 | other | Li4Ni6O12 | 22 | 9 | 205.15 |
mp-778925 | 8.937474 | 9.264533 | 0.0088 | other | Na12Cu2O8 | 22 | 9 | 298.87 |
mp-1182281 | 4.756137 | 3.392895 | -3.735311 | other | Ba2N12O2 | 16 | 9 | 262.67 |
mp-28922 | 2.854221 | 2.323834 | 1.690151 | other | Ca4Si10N16 | 30 | 9 | 360.89 |
mp-1225839 | -4.585804 | -1.324698 | -5.94441 | other | Cu4Si2S6 | 12 | 9 | 216.46 |
mp-761589 | 6.739286 | 13.17921 | -2.349723 | other | Nb2Co6O16 | 24 | 9 | 259.88 |
mp-674508 | 8.134519 | 0.875185 | 1.329728 | other | Rb2Pb2F6 | 10 | 9 | 204.62 |
mp-1209151 | -6.075851 | -1.161178 | 3.469417 | other | Si8Mo16Pt10 | 34 | 9 | 528.05 |
mp-767723 | 9.97469 | 2.400667 | 0.478174 | other | Li2V4F18 | 24 | 9 | 326.01 |
mp-753203 | 9.930397 | 12.059246 | -4.607454 | other | V2O4F2 | 8 | 9 | 95.58 |
mp-756084 | 9.17982 | 9.064793 | 0.318196 | other | Ba2Na8O6 | 16 | 9 | 298.31 |
mp-1003767 | 8.383293 | 14.843994 | -0.942208 | other | Na6Mn12O24 | 42 | 9 | 528.3 |
mp-625111 | 10.17587 | 3.813495 | -4.076365 | other | H16Pt2O12 | 30 | 9 | 227.01 |
mp-758094 | 9.67651 | 8.760157 | 3.15896 | other | Ce12Y4O30 | 46 | 9 | 646.66 |
mp-771185 | 11.71745 | 7.367778 | -0.636702 | other | K12Ge12O30 | 54 | 9 | 937.72 |
mp-704492 | 10.381154 | 7.886986 | -6.993077 | other | Mn16P16O64 | 96 | 9 | 1,536.63 |
mp-645206 | 10.208957 | 10.658767 | -3.408655 | other | Cu8Re8O32 | 48 | 9 | 750.35 |
mp-685991 | -3.505249 | -4.307541 | 0.874259 | other | Li10Si2P6 | 18 | 9 | 305.79 |
mp-850207 | 8.468704 | 14.842602 | -1.736511 | other | Mn8O14F2 | 24 | 9 | 245.74 |
mp-38347 | -3.892828 | -4.249522 | -3.645305 | other | Ca2Pr16Se24 | 42 | 9 | 1,096.17 |
mp-764189 | 10.351963 | 0.955683 | 1.646971 | other | Li6Mn4F14 | 24 | 9 | 288.25 |
mp-505199 | 14.334712 | 7.576554 | -5.689588 | other | Ti6P18O54 | 78 | 9 | 1,026.45 |
mp-1179675 | 12.097115 | 6.97035 | -5.964984 | other | U4P12O42 | 58 | 9 | 947.38 |
mp-1248282 | 6.685017 | 9.002172 | -1.325464 | other | Al4Bi6O18 | 28 | 9 | 374.08 |
mp-31780 | 13.831288 | 8.236598 | -6.237746 | other | Fe8P6O24 | 38 | 9 | 466.11 |
mp-755593 | 9.019795 | 12.298556 | -0.064054 | other | Li8Co2O6 | 16 | 9 | 164.42 |
mp-1183018 | -3.592206 | -1.270264 | -5.437671 | other | Ag6Sb2S6 | 14 | 9 | 346.7 |
mp-660318 | 11.837986 | 6.765065 | -1.622855 | other | Cd4Si2O8 | 14 | 9 | 183.63 |
mp-625555 | 10.29617 | 3.060675 | -3.976748 | other | H14Br2O6 | 22 | 9 | 232.45 |
mp-9403 | 13.101729 | 7.649405 | -7.164606 | other | Cr6P18O54 | 78 | 9 | 982.98 |
mp-540440 | 9.290219 | 7.974547 | -5.761851 | other | Fe2P4O14 | 20 | 9 | 257.09 |
mp-15896 | -5.098071 | -2.84284 | -4.269875 | other | Cu4Si2Se6 | 12 | 9 | 247.97 |
mp-561013 | 11.56471 | 7.82893 | -0.390872 | other | Ga4Pb2O8 | 14 | 9 | 212.59 |
mp-773170 | 9.675411 | 13.500754 | -1.57006 | other | Cr6Sb2O16 | 24 | 9 | 284.39 |
mp-1179405 | 8.23823 | 5.138546 | -4.022961 | other | Sr2H8O12 | 22 | 9 | 225.94 |
mp-752973 | 10.647969 | 0.007739 | 0.173276 | other | Li2Mn2F8 | 12 | 9 | 138.93 |
mp-2223159 | 12.204748 | -0.40047 | 0.240961 | other | Mn4O4F6 | 14 | 9 | 165.93 |
mp-625385 | 8.039326 | 4.361939 | -4.567689 | other | H4N4O4 | 12 | 9 | 123.53 |
mp-625836 | 8.313121 | 5.12506 | -3.837778 | other | Sr2H8O12 | 22 | 9 | 220.35 |
mp-1179424 | 13.496335 | 7.50043 | -1.232499 | other | Si20H20O30 | 70 | 9 | 1,028.31 |
mp-765688 | 12.649508 | 7.574481 | 0.576916 | other | La2Al24O38 | 64 | 9 | 615.66 |
mp-1103551 | -4.429035 | -2.465823 | -3.564448 | other | K4Se8N2 | 14 | 9 | 431.58 |
mp-29959 | -4.402081 | -2.551759 | -3.701177 | other | Tl2B2Se6 | 10 | 9 | 250.63 |
mp-1181670 | 6.635602 | 6.149889 | -3.831784 | other | Fe2Bi2O6 | 10 | 9 | 517.88 |
mp-1232389 | -5.867577 | -3.17685 | -2.156592 | other | Mn2Cd2Te2 | 6 | 9 | 113.85 |
mp-626260 | 10.440637 | 3.726718 | -4.104578 | other | Sr2H32O20 | 54 | 9 | 482.49 |
mp-1182718 | 6.404694 | 7.24261 | -2.287703 | other | Fe2Bi2O6 | 10 | 9 | 2,832.2 |
mp-1205034 | 8.211332 | 7.220664 | -4.065563 | other | Ce4Se8O34 | 46 | 9 | 727.95 |
mp-11658 | -5.234423 | -2.781297 | -4.212218 | other | Cu4Sn2Se6 | 12 | 9 | 288.05 |
mp-767671 | 9.829588 | 1.888587 | 1.677548 | other | Li6V2F12 | 20 | 9 | 263.17 |
mp-698583 | 10.0368 | 8.954397 | -6.210242 | other | V4P4O20 | 28 | 9 | 326.72 |
mp-654372 | 1.461679 | 2.606117 | -5.879849 | other | K48Co24Cl96 | 168 | 9 | 5,042.71 |
mp-774736 | -4.542886 | -1.469801 | -5.767555 | other | Li4Cu4S4 | 12 | 9 | 203.15 |
mp-1178324 | 10.552762 | 0.681561 | 0.207967 | other | Fe6O2F14 | 22 | 9 | 310.91 |
mp-1229319 | 9.478621 | 8.221888 | -5.186379 | other | Co40As24O114 | 178 | 9 | 2,153.05 |
mp-755396 | 9.853252 | 12.175643 | 0.221618 | other | Li16Mn4O12 | 32 | 9 | 338.17 |
mp-759960 | 9.610304 | 1.898255 | -0.066013 | other | Li6V6F36 | 48 | 9 | 665.92 |
mp-657300 | 2.001833 | 2.795987 | -4.408578 | other | Rh12S12Cl60 | 84 | 9 | 2,257.25 |
mp-1214354 | 7.349983 | 7.623998 | -4.066467 | other | Cr4P4O40 | 48 | 9 | 991.86 |
mp-8761 | -2.833757 | 0.606978 | 2.603538 | other | Nd2Co2C4 | 8 | 9 | 103.33 |
mp-10419 | 1.501915 | 2.168188 | 1.351317 | other | Na8Re2N6 | 16 | 9 | 261.1 |
mp-14535 | 13.011614 | 6.380408 | -6.805571 | other | In6P18O54 | 78 | 9 | 1,032.77 |
mp-1232653 | -5.569095 | -0.261447 | -5.86082 | other | Cr4Ag4S8 | 16 | 9 | 292.63 |
mp-10519 | -4.753444 | -1.246764 | -5.930128 | other | Cu4Sn2S6 | 12 | 9 | 239.69 |
mp-1569694 | 8.978798 | 9.906903 | 0.030537 | other | Na12Ni2O8 | 22 | 9 | 282.29 |
mp-1226861 | -2.843306 | -3.409385 | -4.173103 | other | Ce6As2S6 | 14 | 9 | 316.3 |
mp-1227040 | 7.9625 | 6.08084 | -3.509279 | other | Cd2Ge2O6 | 10 | 9 | 137.79 |
mp-764074 | 5.769 | 11.374594 | -1.646684 | other | Na4Fe2O6 | 12 | 9 | 135.87 |
mp-36066 | 4.755211 | 2.957986 | -1.179439 | other | P2N2O2 | 6 | 9 | 75.16 |
mp-677526 | 9.084888 | 7.009246 | -3.38128 | other | Rb4Se2O8 | 14 | 9 | 300.93 |
mp-1232381 | -6.081087 | -3.601495 | -2.367608 | other | Zn2Cd2Te2 | 6 | 9 | 161.5 |
mp-752668 | 8.504276 | 15.369301 | -0.618105 | other | Li4Mn6O12 | 22 | 9 | 231.15 |
mp-675964 | -4.917476 | -5.172076 | 0.386687 | other | Li10Ge2As6 | 18 | 9 | 337.35 |
mp-31373 | 10.571076 | 3.691009 | -4.242953 | other | H36S2O24 | 62 | 9 | 558.4 |
mp-677072 | -6.076148 | -3.508893 | -1.975321 | other | Ca1In2Te4 | 7 | 97 | 244.34 |
mp-1223951 | -5.997565 | -3.497216 | -1.957738 | other | In3Sb1Te4 | 8 | 97 | 250.87 |
mp-1223965 | -6.061038 | -3.564793 | -1.930465 | other | In3Bi1Te4 | 8 | 97 | 258.51 |
mp-30531 | -4.267659 | -0.959937 | -3.181591 | other | Ta4Se16I2 | 22 | 97 | 623.05 |
mp-2646994 | -6.1388 | -3.614776 | 3.868063 | other | Zr4Cu1Pd1 | 6 | 97 | 119.06 |
mp-1219939 | -7.015305 | -6.326012 | 2.170891 | original | Pd1Pb4Au1 | 6 | 97 | 150.04 |
mp-1217290 | -6.285226 | -5.806242 | 5.791795 | other | Th4Al1Ge1 | 6 | 97 | 168.78 |
mp-1195593 | 14.044933 | 7.119114 | -5.903865 | other | U4P16O48 | 68 | 97 | 981.27 |
mp-1219917 | -6.999398 | -5.961204 | 2.180811 | other | Pd1Rh1Pb4 | 6 | 97 | 137.5 |
mp-1225052 | -7.272104 | -3.739576 | 2.662329 | other | Fe1Co1Sn4 | 6 | 97 | 111.06 |
mp-1219327 | -6.030878 | -0.720877 | 3.49422 | other | Si5Ge1W10 | 16 | 97 | 236.47 |
mp-1218900 | -4.649133 | -1.013587 | -4.826405 | other | Sr1Fe2S4 | 7 | 97 | 150.79 |
mp-1215379 | -6.315279 | -3.558258 | 4.004653 | other | Zr4Co1Ni1 | 6 | 97 | 109.26 |
mp-37091 | -6.015548 | -3.539015 | -1.959873 | other | Sr1Al2Te4 | 7 | 97 | 237.39 |
mp-33880 | -6.056003 | -3.522744 | -2.076595 | other | Sr1Ga2Te4 | 7 | 97 | 234.77 |
mp-1224329 | -5.698164 | -3.51767 | 4.371818 | other | Hf4Al1Si1 | 6 | 97 | 115.62 |
mp-1217288 | -5.139863 | -2.784966 | 2.688226 | other | Ti10Fe1Sb5 | 16 | 97 | 287.97 |
mp-1215371 | -6.132834 | -3.681901 | 4.006083 | other | Zr4Cu1Ni1 | 6 | 97 | 113.09 |
mp-1216984 | -5.248578 | -3.495907 | 3.675668 | other | U12Fe1Ni1 | 14 | 97 | 269.4 |
mp-1217989 | -5.89267 | -1.873403 | 3.712204 | other | Ta4Co1Ni1 | 6 | 97 | 92.4 |
mp-1217282 | -6.522688 | -5.915462 | 5.692014 | other | Th4Ag1Pd1 | 6 | 97 | 165.65 |
mp-1222132 | -7.014816 | -1.082652 | 3.724609 | other | Mn10Cu1Ge5 | 16 | 97 | 212.39 |
mp-1221689 | -7.330705 | -3.895968 | 2.578615 | other | Mn1Co1Sn4 | 6 | 97 | 116.61 |
mp-676036 | -4.511541 | -1.033073 | -4.815715 | other | Ba1Fe2S4 | 7 | 97 | 161.76 |
mp-1215366 | -6.070734 | -3.733311 | 3.982912 | other | Zr4Fe1Ni1 | 6 | 97 | 111.54 |
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