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-7219 | -4.761187 | -2.922856 | -3.621835 | other | Na4Zr2Se6 | 12 | 12 | 286.57 |
mp-1045492 | -4.887713 | -1.016081 | -5.337371 | other | Y2Mn4S8 | 14 | 12 | 295 |
mp-11639 | -3.515648 | -1.39881 | -5.403479 | other | Rb4Ge2S6 | 12 | 12 | 372.74 |
mp-1179025 | 10.371671 | 9.947548 | 0.974993 | other | Ti3Bi4O12 | 19 | 12 | 251.01 |
mp-754098 | 9.790971 | 12.86257 | -3.773547 | other | Li2V2O6 | 10 | 12 | 109.48 |
mp-18957 | 8.549621 | 15.436473 | -0.156349 | other | Na1Mn1O2 | 4 | 12 | 42.93 |
mp-1174044 | 4.01975 | 19.527601 | -1.830346 | other | Li6Co4O10 | 20 | 12 | 178.57 |
mp-1210863 | 6.072849 | 3.71214 | -4.588374 | other | Mn1C6O6 | 13 | 12 | 598.69 |
mp-768114 | 11.461276 | 12.735958 | 1.703772 | other | Li12Ti18O40 | 70 | 12 | 755.93 |
mp-28580 | 0.888995 | 1.194281 | -4.685833 | other | Y4N2Cl6 | 12 | 12 | 275.66 |
mp-561583 | 10.573353 | 9.621091 | -2.714149 | other | Co14As4O24 | 42 | 12 | 453.8 |
mp-5594 | 12.753155 | 6.437508 | 0.053426 | original | Sc2Si2O7 | 11 | 12 | 127.04 |
mp-1225254 | -7.080578 | -6.48854 | 3.601746 | other | Eu2Ag2Ge2 | 6 | 12 | 140.72 |
mp-557809 | 2.141518 | 2.798951 | -4.425624 | other | Sb2S2Cl18 | 22 | 12 | 670.71 |
mp-759178 | 8.521083 | 12.118123 | -0.703277 | original | Zn2Ni3O5 | 10 | 12 | 97.03 |
mp-1214592 | 8.832412 | 1.190254 | 1.398382 | other | Ba4Zn6F20 | 30 | 12 | 411.45 |
mp-1400858 | 6.253414 | 12.535387 | -1.454965 | other | Zn2Ni4O8 | 14 | 12 | 145.99 |
mp-766163 | 9.756173 | 10.097958 | 0.177347 | other | Ti1Sn9O20 | 30 | 12 | 359.01 |
mp-1220833 | -7.722066 | -4.599408 | 2.908704 | other | Pr9Ni24Sn49 | 82 | 12 | 1,741.93 |
mp-1237978 | -3.345676 | -1.8948 | -5.448301 | other | Yb4Mg4S12 | 20 | 12 | 422.65 |
mp-31518 | 8.470471 | 12.74431 | -1.504767 | other | Nb2Co2O8 | 12 | 12 | 146.76 |
mp-25579 | 12.724045 | 11.22165 | -1.343454 | other | Y1Mo3O8 | 12 | 12 | 161.41 |
mp-1181921 | 6.831645 | 6.027012 | -3.969112 | other | Ca2S2O12 | 16 | 12 | 320.17 |
mp-31372 | 12.353661 | 13.241031 | -1.569807 | other | Li3V6O13 | 22 | 12 | 234.58 |
mp-1225032 | 13.531868 | 5.084466 | -2.357955 | other | Ga8B4O18 | 30 | 12 | 372.3 |
mp-1194550 | -4.739935 | -5.349954 | 0.595423 | other | Ca42Zn8As36 | 86 | 12 | 2,100.19 |
mp-1173945 | 6.797309 | 19.795593 | -0.276024 | other | Li6Mn4O10 | 20 | 12 | 182.69 |
mp-1196239 | 10.630655 | 11.879137 | 0.261054 | other | Lu6Fe12O24 | 42 | 12 | 526.58 |
mp-1213692 | -6.034959 | -3.285627 | -2.508414 | other | Cs2Ag6Te4 | 12 | 12 | 365.89 |
mp-22629 | -7.412402 | -4.10346 | 5.495044 | other | Tb4Co2Ge4 | 10 | 12 | 210.02 |
mp-674499 | -4.118224 | -0.061877 | -3.817286 | other | Nb17Ir3S40 | 60 | 12 | 1,241.65 |
mp-1209506 | -4.722532 | -3.068604 | -3.489395 | other | Rb6Bi18Se30 | 54 | 12 | 1,762.66 |
mp-1192386 | -8.268504 | -5.244686 | 2.791528 | other | Nd6Sn10Pd10 | 26 | 12 | 568.81 |
mp-1025151 | -5.642104 | -1.435558 | -3.71125 | other | Cr2Ni1Se4 | 7 | 12 | 127.6 |
mp-1281871 | 6.972668 | 10.853677 | -1.007398 | other | K4Co4O8 | 16 | 12 | 255.35 |
mp-7028 | 8.731205 | 1.743787 | 0.48284 | other | Yb2O2F2 | 6 | 12 | 76.2 |
mp-756103 | 9.876667 | 8.832748 | 3.017226 | other | Y4Hg2O8 | 14 | 12 | 208.03 |
mp-1221924 | -1.091302 | 2.719411 | -3.138273 | other | Mn2Cr1I6 | 9 | 12 | 325.2 |
mp-753841 | 12.53193 | 12.394035 | -0.327952 | other | Mg8V5O16 | 29 | 12 | 301.68 |
mp-1220729 | 3.231281 | -0.417156 | -2.294903 | other | Nb2H8Se4 | 14 | 12 | 166.37 |
mp-1222319 | -9.003734 | -6.099172 | 3.689453 | other | Lu2Ga2Au2 | 6 | 12 | 117.16 |
mp-1282942 | 5.58016 | 10.575552 | -2.134461 | other | Li12Fe4O16 | 32 | 12 | 278.62 |
mp-1069855 | 4.235416 | 4.189304 | -3.679942 | other | Co1Cl2O2 | 5 | 12 | 97.24 |
mp-757215 | 10.595093 | 8.300727 | 1.360684 | other | Gd5As2O12 | 19 | 12 | 260.9 |
mp-25258 | 6.45561 | 13.282106 | -1.303336 | other | Li4Ni4O8 | 16 | 12 | 148.09 |
mp-1221242 | 6.422515 | 13.757067 | -1.723298 | other | Na3Co4O8 | 15 | 12 | 169.2 |
mp-1215645 | -4.722937 | -1.901024 | -3.156852 | other | Zr2Ni1Se4 | 7 | 12 | 146.5 |
mp-1098010 | 7.256513 | 9.073726 | 0.494686 | other | Li2Eu5O8 | 15 | 12 | 197.92 |
mp-752850 | 6.34938 | 13.531746 | -1.288885 | other | Li4Ni4O8 | 16 | 12 | 132.98 |
mp-1246451 | 0.517951 | 2.693544 | 1.730225 | other | Fe2Ni9N8 | 19 | 12 | 217.97 |
mp-1103598 | -5.357567 | -1.482816 | -3.423872 | other | Rb1V5Se8 | 14 | 12 | 305.04 |
mp-1245778 | 1.480388 | 2.461987 | 1.644373 | other | Mg9Fe2N8 | 19 | 12 | 231.32 |
mp-1176693 | 10.107565 | 0.539523 | 0.413119 | other | Li2Fe2F8 | 12 | 12 | 157.91 |
mp-1224764 | -6.182639 | -2.971314 | -2.253182 | other | Gd1Cu5Te4 | 10 | 12 | 225.41 |
mp-1004758 | 8.537268 | 14.635177 | -1.221526 | other | Mn3H2O6 | 11 | 12 | 97.52 |
mp-766216 | 11.787867 | 11.267976 | -2.048654 | other | Na4W9O27 | 40 | 12 | 508.75 |
mp-761132 | 8.476508 | 9.649745 | 0.400226 | other | Ta5Pb11O26 | 42 | 12 | 646.84 |
mp-766058 | 9.15222 | 13.272165 | -1.097517 | other | Na2Fe16O24 | 42 | 12 | 473.25 |
mp-1174387 | 6.950803 | 19.786402 | -0.156899 | other | Li8Mn6O14 | 28 | 12 | 260.57 |
mp-683986 | -3.038038 | -2.382669 | -4.776864 | other | Yb11U4S22 | 37 | 12 | 885.27 |
mp-31012 | -0.767496 | 0.855719 | -3.744244 | other | K4Nb6Br18 | 28 | 12 | 857.11 |
mp-1211896 | 8.76597 | 1.607345 | 0.830401 | other | K3P1F6 | 10 | 12 | 277.6 |
mp-850422 | 6.041705 | 12.454281 | -2.404749 | other | Fe6O8F4 | 18 | 12 | 201.81 |
mp-1225709 | -1.209978 | 2.511226 | -3.392622 | other | Cu4I3Br1 | 8 | 12 | 181.37 |
mp-1201357 | -5.778937 | -3.798863 | -1.60128 | other | Cs3Tm11Te18 | 32 | 12 | 1,169.13 |
mp-1226121 | -4.707866 | -3.032908 | -3.518632 | other | Cs2Bi8Se14 | 24 | 12 | 863.91 |
mp-1216193 | -7.090407 | -1.500705 | 6.380034 | other | Y1Al9Fe3 | 13 | 12 | 197.08 |
mp-755360 | 5.709706 | 13.461826 | -1.756334 | other | Na4Co2O6 | 12 | 12 | 124.74 |
mp-1194009 | -4.143412 | -3.63596 | -2.710703 | other | Mg1U8Se17 | 26 | 12 | 675.63 |
mp-1221290 | 7.098132 | 8.408772 | -1.042984 | other | Na4Tb2O6 | 12 | 12 | 173.93 |
mp-1025181 | -3.128019 | 0.556241 | 2.633238 | other | Tm2Cr2C3 | 7 | 12 | 89.99 |
mp-31745 | 11.429486 | 7.770126 | -7.173923 | other | Cr2P8O24 | 34 | 12 | 527.4 |
mp-1400773 | 8.362108 | 13.277858 | -0.758289 | other | Ca2Fe4O8 | 14 | 12 | 173.16 |
mp-1078035 | -3.043464 | 0.562702 | 2.571871 | other | Sm2Cr2C3 | 7 | 12 | 98.43 |
mp-1095140 | -7.634698 | -3.513697 | 5.39075 | other | Er4Co2Ge4 | 10 | 12 | 189.62 |
mp-754039 | 11.750393 | 11.615347 | -0.761491 | other | Y2V2O7 | 11 | 12 | 165.15 |
mp-1079622 | -4.736019 | -5.219239 | 0.585245 | other | Ba3Zn2As4 | 9 | 12 | 255.91 |
mp-22007 | -3.927895 | -1.378049 | -5.720459 | other | Cs1In5S8 | 14 | 12 | 342.22 |
mp-1225205 | -8.245816 | -6.275462 | 3.039295 | other | Eu2Ga2Au2 | 6 | 12 | 136.48 |
mp-27247 | 10.78765 | 10.865988 | 2.898964 | other | Na12Nb4O16 | 32 | 12 | 388.05 |
mp-1209378 | -1.05953 | 1.094739 | -1.617609 | other | Pr4Os1I5 | 10 | 12 | 387.39 |
mp-707440 | 3.420785 | -0.676417 | -2.520485 | other | Sr4Mg6H20 | 30 | 12 | 348.72 |
mp-1193786 | -5.392867 | -5.786183 | 0.712518 | other | Eu11Zn6Sb12 | 29 | 12 | 865.84 |
mp-18482 | -7.295288 | -3.458848 | 5.857165 | other | Yb4Al23Ni6 | 33 | 12 | 549.93 |
mp-1226477 | -6.28181 | -3.524878 | 0.748314 | other | Co20Sb60I4 | 84 | 12 | 1,885.21 |
mp-1219645 | -4.7121 | -3.004159 | -3.520234 | other | Rb2Bi8Se14 | 24 | 12 | 821.88 |
mp-23062 | -0.574681 | 0.757952 | -2.129903 | other | Y2C2I2 | 6 | 12 | 152.5 |
mp-777772 | 12.066863 | -0.672483 | 1.062164 | other | Mn8O4F12 | 24 | 12 | 303.33 |
mp-1220563 | -7.352049 | 0.813555 | 5.040414 | other | Nd2Fe14Si3 | 19 | 12 | 258.55 |
mp-1214345 | -4.788329 | -4.089704 | 5.343206 | other | Ba2Si24Pt10 | 36 | 12 | 612.82 |
mp-23382 | -0.843328 | 1.006952 | -1.632386 | other | Y4C1I5 | 10 | 12 | 314.26 |
mp-676402 | -4.102053 | -0.130958 | -4.559765 | other | Ti8Cu3S16 | 27 | 12 | 471.29 |
mp-1182562 | -2.929543 | -8.030951 | 1.288446 | other | Bi2Pd3S2 | 7 | 12 | 2,708.98 |
mp-1174068 | 6.798147 | 19.644386 | -0.288654 | other | Li6Mn4O10 | 20 | 12 | 184.23 |
mp-1232143 | -4.478997 | -3.92226 | -3.838429 | other | La2Mg2Se6 | 10 | 12 | 306.94 |
mp-30075 | -4.171544 | -0.09855 | -4.386544 | other | Ti4Fe1S8 | 13 | 12 | 220.98 |
mp-1215631 | -7.975926 | -4.872731 | 3.103854 | other | Yb2Ge2Pd2 | 6 | 12 | 120.34 |
mp-1226060 | 7.495141 | 12.789275 | -1.933884 | other | Co4Sb1O8 | 13 | 12 | 147.73 |
mp-5864 | -2.874352 | -0.310547 | -5.164502 | other | Fe4P4S12 | 20 | 12 | 413.33 |
mp-1205799 | -4.19716 | 1.961109 | -4.926375 | other | Mo2S4I4 | 10 | 12 | 316.42 |
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