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-756683 | 6.666119 | 8.914693 | -0.576723 | other | Hf4Bi4O16 | 24 | 2 | 329.09 |
mp-753916 | 11.043333 | 13.107521 | -3.406723 | other | V6Fe2O16 | 24 | 2 | 285.79 |
mp-863399 | 10.845727 | 12.972352 | -3.156114 | other | V18Cu20O57 | 95 | 2 | 1,050.37 |
mp-667421 | 10.152267 | 9.255852 | -1.8091 | other | Sr24Te24O72 | 120 | 2 | 2,262.3 |
mp-756652 | 9.441823 | 8.213297 | -6.243151 | other | Co4P4O16 | 24 | 2 | 318.99 |
mp-570965 | -0.182322 | 0.508792 | -3.017993 | other | Pr6Co1Br10 | 17 | 2 | 596.83 |
mp-695836 | 9.16797 | 8.381479 | -1.978374 | other | K2Sb2O6 | 10 | 2 | 179.56 |
mp-28575 | -0.629864 | 0.952515 | -4.382666 | other | W2S16Cl12 | 30 | 2 | 827.06 |
mp-18318 | 12.387699 | 6.667918 | 0.107667 | other | Tm8Si8O28 | 44 | 2 | 503.01 |
mp-1237913 | 7.970727 | 7.620649 | -4.431999 | other | Zn3P2O12 | 17 | 2 | 225.88 |
mp-1185517 | 3.406672 | -0.713937 | -2.525958 | other | Mg1Al2H8 | 11 | 2 | 123.2 |
mp-1101715 | 12.395109 | 12.696441 | -0.594113 | other | V4Cr4O12 | 20 | 2 | 198.97 |
mp-1104554 | -5.8499 | 1.645342 | -4.905382 | other | Mo6Pb1S8 | 15 | 2 | 292.57 |
mp-1174244 | 7.067674 | 19.570553 | -0.166336 | other | Li8Mn6O14 | 28 | 2 | 258.34 |
mp-1179381 | 10.554853 | 12.149201 | 0.953167 | other | Ti2Co2O6 | 10 | 2 | 168.78 |
mp-1232126 | -2.731318 | -2.571909 | -5.890779 | other | Dy8Mg4S16 | 28 | 2 | 767.31 |
mp-685503 | -1.187437 | 1.879564 | -2.16169 | other | K4Zr48I112 | 164 | 39 | 6,832.21 |
mp-27129 | 8.699945 | 1.869252 | 2.453545 | other | Y14O12F18 | 44 | 39 | 607.67 |
mp-625998 | 10.990129 | 4.143551 | -3.828999 | other | Li2H2O2 | 6 | 39 | 57.78 |
mp-686102 | -4.62193 | -2.956725 | -4.007243 | other | Tl24In16Se40 | 80 | 39 | 2,373.99 |
mp-675254 | 13.972206 | 5.426238 | -6.720446 | other | Al6P6O24 | 36 | 39 | 646.9 |
mp-1216049 | 6.578915 | 5.015536 | -4.981853 | other | Y2N2O8 | 12 | 39 | 157.91 |
mp-29839 | 10.397332 | 8.32244 | -2.32707 | other | Bi8Se4O20 | 32 | 39 | 511.8 |
mp-759894 | 7.921004 | 2.33969 | 0.952074 | other | Bi14O12F18 | 44 | 39 | 711.39 |
mp-759728 | 10.992435 | 8.762919 | -1.348308 | other | Sb14O12F18 | 44 | 39 | 786.04 |
mp-23334 | 10.079659 | 8.890838 | -1.373049 | other | Bi8Te4O20 | 32 | 39 | 529.01 |
mp-532443 | 1.625872 | 2.39621 | -5.031048 | other | Li10V10Cl32 | 52 | 39 | 1,127.87 |
mp-1220841 | -9.201323 | -0.496783 | 4.41134 | other | Na4B16Ir12 | 32 | 39 | 470.66 |
mp-727235 | 2.285706 | 2.733751 | -3.761706 | other | Ca2N4Cl4 | 10 | 39 | 262.86 |
mp-1224153 | 6.604487 | 4.93123 | -5.048789 | other | Ho2N2O8 | 12 | 39 | 153.3 |
mp-766276 | 9.170745 | 8.74962 | 1.682029 | other | Ba8In8O20 | 36 | 39 | 621.77 |
mp-1638951 | 6.26686 | 13.006724 | -2.776155 | other | Co8O12F4 | 24 | 39 | 237.12 |
mp-774621 | 8.890656 | 12.619855 | -0.08207 | other | Li10Mn2O8 | 20 | 41 | 201.95 |
mp-622198 | 10.377019 | 9.949289 | 0.972766 | other | Ti6Bi8O24 | 38 | 41 | 501.62 |
mp-1203040 | 12.225743 | 5.962456 | -2.426793 | other | B8Pb16O28 | 52 | 41 | 892.89 |
mp-23427 | 10.373178 | 9.92881 | 0.999784 | other | Ti6Bi8O24 | 38 | 41 | 488.31 |
mp-1228421 | 1.336315 | 2.049767 | 1.409034 | other | Ba4Ni6N4 | 14 | 41 | 273.81 |
mp-774500 | 7.409326 | 12.346856 | -0.84405 | other | Li20Ni4O16 | 40 | 41 | 391.58 |
mp-725525 | 7.644717 | 6.735248 | -4.467327 | other | K4Al4O14 | 22 | 41 | 356.4 |
mp-25912 | 14.076471 | 8.683627 | -6.772232 | other | V6P12O40 | 58 | 41 | 884.17 |
mp-766345 | 8.61098 | 1.828307 | 2.457815 | other | Y20O16F28 | 64 | 41 | 861.67 |
mp-1180867 | 9.470819 | 6.063507 | -3.697297 | other | K2B10O24 | 36 | 41 | 563.4 |
mp-23329 | 10.494563 | 9.956089 | -1.407115 | other | Bi4W2O12 | 18 | 41 | 249.47 |
mp-1279318 | 5.57131 | 10.870462 | -2.007458 | other | Li6Fe2O8 | 16 | 41 | 144.46 |
mp-760230 | 7.971556 | 2.331756 | 1.129725 | other | Bi20O16F28 | 64 | 41 | 973.57 |
mp-754280 | 7.830355 | 12.533049 | -0.675066 | other | Li10Co2O8 | 20 | 41 | 186.87 |
mp-759798 | 7.952104 | 2.404992 | 1.088581 | other | Bi28O24F36 | 88 | 41 | 1,362.46 |
mp-729568 | 6.051697 | 5.118582 | -4.432868 | other | Hg16N12O40 | 68 | 41 | 1,259.83 |
mp-30161 | 3.290559 | 2.466741 | 1.181132 | other | Si4C2N8 | 14 | 41 | 184.83 |
mp-28631 | 13.011477 | 10.637932 | -0.280085 | other | Nd2Mo16O28 | 46 | 41 | 631.14 |
mp-773252 | 5.970052 | 12.996236 | -1.413209 | other | Li4Ni6O12 | 22 | 41 | 215.77 |
mp-28454 | 13.023767 | 10.642952 | -0.279482 | other | Sm2Mo16O28 | 46 | 41 | 628.93 |
mp-560456 | 9.972109 | 9.26501 | -2.229455 | other | Hg16Te16O56 | 88 | 41 | 1,276.63 |
mp-760107 | 15.143299 | 12.326853 | -1.004475 | other | V28O24F36 | 88 | 41 | 911.25 |
mp-779465 | 12.306405 | 12.752042 | 2.384505 | other | Ti34N12O48 | 94 | 40 | 1,113.44 |
mp-755241 | 12.817558 | -0.836422 | 0.401938 | other | Mn8O8F8 | 24 | 40 | 273.59 |
mp-675771 | 13.762505 | 5.772141 | -6.561554 | other | Al12P12O48 | 72 | 40 | 1,477.56 |
mp-761337 | 7.948323 | 11.742444 | 0.961153 | other | Sr6Cr6O18 | 30 | 40 | 364.73 |
mp-1219835 | -6.432143 | -6.275913 | 2.076117 | other | Rb8Sn42Hg4 | 54 | 40 | 1,869.86 |
mp-1203676 | 9.826497 | 7.639455 | -1.694229 | other | Ca16Ge12O44 | 72 | 40 | 1,065.98 |
mp-1191955 | 5.643072 | -0.33211 | -3.158741 | other | Cs2B6H16 | 24 | 40 | 320.99 |
mp-1228313 | -4.078722 | -4.993523 | 5.66068 | other | Ba8Si42Au4 | 54 | 40 | 1,150.32 |
mp-753056 | 13.626489 | 4.687905 | -1.337455 | other | Ho2B2O6 | 10 | 40 | 118.52 |
mp-1223327 | 9.420621 | 4.040421 | -5.563231 | other | La4C2O10 | 16 | 40 | 234.34 |
mp-760405 | 13.562315 | 4.758871 | -1.421513 | other | Er2B2O6 | 10 | 40 | 117.21 |
mp-757115 | 9.734097 | 9.963164 | -1.360661 | other | K2Sb10O26 | 38 | 40 | 518.81 |
mp-30293 | -4.503319 | -3.266789 | -3.787302 | other | Sr4Ge2Se8 | 14 | 40 | 412.76 |
mp-1215682 | 8.712043 | 7.218245 | -3.07875 | original | Yb2B2O6 | 10 | 40 | 121.76 |
mp-1197057 | 2.437896 | 2.942925 | -4.500296 | other | Re6Cl18O10 | 34 | 40 | 1,369.11 |
mp-1225302 | 8.904765 | 8.0787 | -5.374007 | other | Fe10P6O34 | 50 | 40 | 600.93 |
mp-1226308 | -6.401483 | -6.322631 | 2.002531 | other | Cs8Sn42Hg4 | 54 | 40 | 1,891.57 |
mp-753318 | 13.584281 | 4.706796 | -1.403259 | other | Dy2B2O6 | 10 | 40 | 120.54 |
mp-1224628 | 13.536102 | 4.685245 | -1.48181 | other | Gd2B2O6 | 10 | 40 | 122.76 |
mp-1079679 | -5.146862 | -6.907834 | 1.950924 | other | K4Cd2Sn2 | 8 | 40 | 313.31 |
mp-567702 | 1.585198 | 2.743178 | -4.930541 | other | Cs6Re6Cl24 | 36 | 40 | 1,090.52 |
mp-760484 | 13.611141 | 4.742551 | -1.334167 | other | Tm2B2O6 | 10 | 40 | 116.36 |
mp-1219757 | 1.423178 | 2.789047 | -5.236905 | other | Rb6Mo4Cl16 | 26 | 40 | 821.19 |
mp-1224491 | -6.458933 | -6.321279 | 2.105872 | other | K8Sn42Hg4 | 54 | 40 | 1,859.03 |
mp-849760 | 12.566934 | 7.534312 | 0.604895 | other | Al22Ag2O34 | 58 | 40 | 630.25 |
mp-21892 | 12.347493 | 7.448351 | 0.458937 | other | Al4Pb2O8 | 14 | 40 | 198.43 |
mp-1228302 | -4.090968 | -4.97462 | 5.665007 | other | Ba8Cu4Si42 | 54 | 40 | 1,123.24 |
mp-1216581 | -6.159627 | -0.825405 | 3.54969 | other | V4Fe2Si2 | 8 | 40 | 94.5 |
mp-753153 | 10.469563 | 4.13735 | -4.294223 | other | Dy4C2O10 | 16 | 40 | 192.66 |
mp-554786 | 11.245557 | 10.949197 | -3.857726 | other | Rb8Mo8O28 | 44 | 40 | 841.15 |
mp-1225809 | -5.921224 | -4.37325 | 0.796369 | other | Cu24Sb4As4 | 32 | 40 | 457.6 |
mp-1228316 | -4.074306 | -4.97415 | 5.647687 | other | Ba8Si44Au2 | 54 | 40 | 1,142.13 |
mp-754726 | 13.231411 | 0.38835 | 0.879168 | other | Fe4O4F4 | 12 | 40 | 139.92 |
mp-1220590 | -5.598489 | -2.562771 | 3.377877 | other | Nb6Sn2H2 | 10 | 40 | 156.22 |
mp-1226688 | -5.958791 | -3.451541 | -1.780317 | other | Gd6Cu4Te14 | 24 | 40 | 693.86 |
mp-30294 | -3.26385 | -1.795289 | -5.518846 | other | Sr4Sn2S8 | 14 | 40 | 383.23 |
mp-989617 | 0.903138 | 2.602992 | 1.858859 | other | Y2W2N6 | 10 | 40 | 151.5 |
mp-1225223 | 10.771749 | 6.330602 | -2.850758 | other | Eu2B2O6 | 10 | 40 | 128.79 |
mp-1228889 | -5.740936 | -5.613363 | 3.388382 | other | Ba8Cd4Ge40 | 52 | 40 | 1,331.15 |
mp-1180968 | 6.419203 | 6.25206 | -3.782043 | other | La2Cl6O18 | 26 | 40 | 690.35 |
mp-758571 | 12.584865 | 7.569765 | 0.590218 | other | Al22Tl2O34 | 58 | 40 | 639.06 |
mp-20496 | 11.564067 | 7.829157 | -0.390714 | other | Ga4Pb2O8 | 14 | 40 | 212.67 |
mp-766341 | 9.7658 | 10.012837 | -1.36269 | other | Na2Sb10O26 | 38 | 40 | 507.06 |
mp-759718 | 6.98275 | 11.827983 | 1.708761 | other | Ba10Mn10O28 | 48 | 40 | 665.87 |
mp-773965 | 10.898993 | 11.60882 | 2.556004 | other | Nb20Pb10O60 | 90 | 40 | 1,334.71 |
mp-1228105 | -5.09319 | -4.931013 | 0.494669 | other | Ce2Cd6As6 | 14 | 40 | 381.19 |
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