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-685477 | 9.269448 | 10.3944 | -3.155782 | other | Tc12Bi2O36 | 50 | 1 | 814.7 |
mp-760314 | 10.494151 | 2.248202 | -0.19753 | other | V6O5F19 | 30 | 1 | 431.78 |
mp-1234938 | 11.873163 | 10.947539 | -2.547448 | other | Mg1Mo6O16 | 23 | 1 | 337.06 |
mp-774048 | 11.494812 | 1.536246 | 2.627985 | other | Fe8O2F14 | 24 | 1 | 300.75 |
mp-849545 | 12.325621 | -0.779766 | 0.918544 | other | Mn12O7F17 | 36 | 1 | 438.48 |
mp-763805 | 12.141014 | 11.152775 | -1.406027 | other | Na7W9O27 | 43 | 1 | 558.42 |
mp-764159 | 11.396975 | 2.957561 | 1.311294 | other | V8O4F20 | 32 | 1 | 396.27 |
mp-675339 | 8.790744 | 10.524701 | 1.702318 | other | La18Ni12O41 | 71 | 1 | 1,058.21 |
mp-626317 | 10.399203 | 3.742015 | -4.124038 | other | Ca2H32O20 | 54 | 1 | 436.65 |
mp-1226389 | 8.367139 | 2.941264 | -1.679197 | other | Cr1O3F3 | 7 | 1 | 117.9 |
mp-1237332 | 7.036251 | 5.878606 | -3.716758 | other | Mg3S1O9 | 13 | 1 | 257 |
mp-1173730 | 8.657566 | 5.116504 | -5.447885 | other | Na4S2O8 | 14 | 1 | 225.49 |
mp-690550 | 8.160128 | 12.776313 | -1.38924 | other | Co14Ru4O24 | 42 | 1 | 443.68 |
mp-652804 | 11.691198 | 8.143488 | -3.938545 | other | Fe8As10O26 | 44 | 1 | 619.9 |
mp-637062 | 8.046496 | 2.087925 | -0.781954 | other | As6Xe12F54 | 72 | 1 | 1,489.96 |
mp-626282 | 10.493709 | 3.699076 | -4.128026 | other | Sr2H32O20 | 54 | 1 | 456.7 |
mp-776246 | 1.876711 | 1.759801 | 2.829147 | other | Zr16N16O8 | 40 | 1 | 523.04 |
mp-759022 | 5.713959 | 11.862199 | -1.817051 | other | Li10Fe10O24 | 44 | 1 | 443.73 |
mp-1227849 | 7.815638 | 7.776271 | -4.125617 | other | Ca1V4O15 | 20 | 1 | 347.76 |
mp-754785 | 10.360641 | 1.312696 | -1.732898 | other | Co6O5F7 | 18 | 1 | 195.1 |
mp-626094 | 11.7488 | 4.186099 | -3.76201 | other | Al8H24O24 | 56 | 1 | 424.64 |
mp-753664 | 13.230018 | 9.08135 | -5.99815 | other | V4P2O13 | 19 | 1 | 200.64 |
mp-707409 | 9.655983 | 8.574885 | -0.130493 | other | Ca24Bi36O75 | 135 | 1 | 2,530.43 |
mp-757603 | 10.881733 | 12.400197 | 2.289486 | other | Na13Ti24O54 | 91 | 1 | 1,082.06 |
mp-671888 | 2.057437 | 2.896114 | -4.371278 | other | Re2Se4Cl24 | 30 | 1 | 857.65 |
mp-758402 | 11.706089 | 10.782059 | 1.218202 | other | La11V12O36 | 59 | 1 | 740.88 |
mp-1365538 | 9.481647 | 13.044998 | -0.888855 | other | Ca1Fe18O26 | 45 | 1 | 523.34 |
mp-685513 | -2.618494 | -2.793305 | -5.59471 | other | Pr24Mn4S40 | 68 | 1 | 1,593.28 |
mp-704637 | 10.999425 | 11.907324 | 2.573405 | other | Nb12W1O33 | 46 | 1 | 669.73 |
mp-1272833 | 11.894024 | 12.373275 | 0.263508 | other | Li2Cr4O6 | 12 | 1 | 118.18 |
mp-2241324 | 8.996688 | 14.850413 | -0.579575 | other | Mg1Mn5O8 | 14 | 1 | 170.72 |
mp-626500 | 11.595837 | 4.152761 | -3.83336 | other | Al2H6O6 | 14 | 1 | 112.22 |
mp-1192920 | -2.692996 | -2.662617 | -5.49641 | other | La8Fe2S14 | 24 | 1 | 597.72 |
mp-38487 | 6.998068 | 11.087251 | -1.287701 | other | Li7Bi1O6 | 14 | 1 | 133.35 |
mp-38284 | 9.576401 | 8.648404 | 3.209416 | other | Ce8Nd8O28 | 44 | 1 | 686.38 |
mp-787619 | 7.598176 | 4.976763 | -1.695868 | other | Hf16N16O8 | 40 | 1 | 512.67 |
mp-754270 | 12.086546 | 12.637137 | -4.145273 | other | V2O3F3 | 8 | 1 | 105.26 |
mp-625272 | 11.18735 | 4.160919 | -4.038799 | other | Zn6H12O12 | 30 | 1 | 317.92 |
mp-1247859 | -4.042533 | -1.391806 | -5.41141 | other | Ag5Au3S4 | 12 | 1 | 284.47 |
mp-755763 | 11.794213 | 1.352235 | 2.610139 | other | Fe6O2F10 | 18 | 1 | 219.15 |
mp-640740 | 13.841672 | 4.120607 | -2.326228 | other | Na24B52O90 | 166 | 1 | 1,747.57 |
mp-626172 | 10.242871 | 4.316148 | -5.036384 | other | H16S4O20 | 40 | 1 | 405.31 |
mp-773059 | 9.963785 | 12.516701 | -4.166336 | other | V24Cu3O60 | 87 | 1 | 1,117.61 |
mp-2214551 | 13.703014 | 12.240345 | -3.278708 | other | V4O5F7 | 16 | 1 | 216.94 |
mp-1227183 | 10.936391 | 6.960705 | -1.485001 | other | Ca5Si6O18 | 29 | 1 | 391.75 |
mp-2236764 | 10.031173 | 12.2183 | -4.256879 | other | Mg1V28O70 | 99 | 1 | 1,468.45 |
mp-676990 | -5.909694 | -3.751462 | -1.691258 | other | Ba14Al12Te32 | 58 | 1 | 2,108.73 |
mp-1100952 | 10.750877 | 12.850364 | -3.591717 | other | V16Ag7O40 | 63 | 1 | 806.24 |
mp-690570 | 9.758508 | 9.26193 | -0.740896 | other | Ni4Bi9O18 | 31 | 1 | 499.33 |
mp-676935 | -6.565452 | -2.657557 | -1.397466 | other | Cr10Sb3Te7 | 20 | 1 | 434.52 |
mp-626216 | 10.407353 | 3.729225 | -4.110216 | other | Sr1H16O10 | 27 | 1 | 255.38 |
mp-761126 | 9.433228 | 0.797977 | -0.6818 | other | Cu8O2F12 | 22 | 1 | 259.74 |
mp-625653 | 10.258557 | 3.067034 | -3.976368 | other | H36Br4O16 | 56 | 1 | 596.62 |
mp-561374 | 10.181703 | 9.328171 | -1.942609 | other | Ca18Te18O54 | 90 | 1 | 1,591.55 |
mp-2226542 | 7.022127 | 9.45303 | -1.694653 | other | Mg1Ag4O6 | 11 | 1 | 152.38 |
mp-755846 | 5.9666 | 12.432321 | -2.427998 | other | Fe6O8F4 | 18 | 1 | 201.31 |
mp-685315 | 8.276714 | 1.95367 | -0.630113 | other | Ca8As24F120 | 152 | 1 | 2,437.45 |
mp-777302 | 2.542777 | 2.569251 | 1.107335 | other | Sn16N16O8 | 40 | 1 | 534.97 |
mp-759763 | 10.609578 | 7.716178 | 2.166741 | other | La26B8O51 | 85 | 1 | 1,313.08 |
mp-1353690 | 8.534931 | 13.321468 | -1.907238 | other | Mn10Cr6O32 | 48 | 1 | 563.08 |
mp-764768 | 8.314314 | 12.507442 | -0.5091 | other | Li7Co2O6 | 15 | 1 | 167.5 |
mp-1202590 | 9.737633 | 7.093112 | -2.5821 | other | Ca5Si6O22 | 33 | 1 | 478.46 |
mp-1247878 | 6.390809 | 0.382038 | -3.42529 | other | B40H51F3 | 94 | 1 | 1,150.86 |
mp-698692 | 6.223805 | 11.238609 | 0.480301 | other | Sr12Co10O27 | 49 | 1 | 690.9 |
mp-1246279 | -4.362819 | -1.936386 | -3.824147 | other | Zr7Se8N4 | 19 | 1 | 396.21 |
mp-779863 | 1.683641 | 1.804311 | 2.922685 | other | Hf16N16O8 | 40 | 1 | 502.4 |
mp-775824 | 1.878368 | 1.762399 | 2.832163 | other | Zr16N16O8 | 40 | 1 | 522.76 |
mp-626070 | 10.218068 | 6.069745 | -4.401402 | other | Fe16H16O32 | 64 | 1 | 715.24 |
mp-25572 | 12.734351 | 11.330617 | -1.498343 | other | Sc1Mo3O8 | 12 | 1 | 149.73 |
mp-889388 | 7.37214 | 6.102783 | -2.086853 | other | Mn8O13F3 | 24 | 1 | 248 |
mp-675821 | 10.421071 | 9.611197 | 3.354636 | other | Y6Ta2O14 | 22 | 1 | 309.74 |
mp-676400 | 6.46541 | 5.125448 | -4.50962 | other | Tl1N1O2 | 4 | 1 | 75.39 |
mp-694629 | 12.359386 | 9.259099 | -7.227735 | other | V9P12O48 | 69 | 1 | 911.83 |
mp-859121 | 10.838058 | 9.348987 | -0.649159 | other | Sb16Cl4O21 | 41 | 1 | 805.96 |
mp-530701 | -6.812064 | 1.328109 | -4.230413 | other | Ni5Mo24Se32 | 61 | 1 | 1,272.15 |
mp-685820 | -4.721582 | -1.122452 | -5.210422 | other | Sc10Mn17S32 | 59 | 1 | 1,133.63 |
mp-780759 | 13.297712 | 12.139294 | -0.415103 | other | Na1V13O18 | 32 | 1 | 364.64 |
mp-756033 | 13.311598 | 0.470252 | 1.450197 | other | Fe6O5F7 | 18 | 1 | 211.67 |
mp-676854 | -4.06867 | -0.18808 | -3.444734 | other | Ta14Cu3S24 | 41 | 1 | 737.46 |
mp-626566 | 10.714604 | 12.763176 | 2.332225 | other | Ti6H4O14 | 24 | 1 | 288.4 |
mp-1262001 | 12.619013 | 11.527771 | -1.355307 | other | Al4Mo4O14 | 22 | 1 | 259.43 |
mp-676121 | -1.904709 | 0.610168 | -5.165062 | other | Ag6S2I2 | 10 | 1 | 271.08 |
mp-1219580 | -3.077899 | 0.618157 | -3.380738 | other | Re9Mo3Se16 | 28 | 1 | 606.37 |
mp-1040953 | 7.011373 | 13.463816 | -1.504907 | other | Ca6Co12O24 | 42 | 1 | 513.24 |
mp-730197 | -3.195167 | -2.185209 | -4.78246 | other | Dy14Pb3S24 | 41 | 1 | 898.5 |
mp-764852 | 10.514174 | 2.260187 | -0.200814 | other | V6O5F19 | 30 | 1 | 428.94 |
mp-760369 | 12.954559 | -0.916457 | 0.47841 | other | Mn8O8F8 | 24 | 1 | 256.44 |
mp-1234465 | 9.327118 | 13.275836 | -0.922713 | other | Mg1Fe8O12 | 21 | 1 | 231.75 |
mp-780495 | 10.52082 | 2.259359 | -0.19952 | other | V6O5F19 | 30 | 1 | 440.45 |
mp-760021 | 7.396299 | 10.122776 | 0.316173 | other | Ca19Cu24O46 | 89 | 1 | 1,157.73 |
mp-2225278 | 8.962369 | 14.838634 | -0.546425 | other | Mg1Mn2O4 | 7 | 1 | 89.85 |
mp-765274 | 6.480485 | 14.113608 | -1.888689 | other | Li5Co8O16 | 29 | 1 | 288.34 |
mp-674436 | 10.494168 | 9.917199 | 4.01595 | other | Nd1Zr9O20 | 30 | 1 | 363.31 |
mp-703272 | 6.932662 | 5.30349 | -3.862021 | other | K5N1O4 | 10 | 1 | 299.52 |
mp-851257 | 11.046286 | 2.866711 | 1.288778 | other | V8O4F20 | 32 | 1 | 431.42 |
mp-1100888 | 9.454511 | 13.262693 | -0.898275 | other | Zn6Fe48O72 | 126 | 1 | 1,425.93 |
mp-625883 | 10.442303 | 6.283912 | -4.232966 | other | Fe16H16O32 | 64 | 1 | 698.87 |
mp-1178774 | 13.264221 | 8.52102 | -6.612047 | other | V2P4O14 | 20 | 1 | 281.22 |
mp-1180213 | 6.589641 | 6.078851 | -3.836868 | other | Na4Br4O12 | 20 | 1 | 437.19 |
mp-995234 | 8.451035 | 2.396422 | -4.972029 | other | H14C14O14 | 42 | 1 | 462.07 |
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