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-567822 | -6.579411 | -6.76455 | 3.218916 | other | Sr3In11 | 14 | 71 | 399.77 |
mp-1094288 | -4.901003 | -7.437881 | 3.556731 | other | Sr2Mg1 | 3 | 71 | 127.53 |
mp-1222226 | -7.823907 | -7.150485 | 3.502684 | other | Pr12Cd72 | 84 | 71 | 2,050.94 |
mp-1225485 | -7.755847 | -7.180644 | 3.409891 | other | Ho12Cd72 | 84 | 71 | 1,950.01 |
mp-1397070 | 8.708862 | 1.930174 | -0.726058 | other | Cr1F5 | 6 | 71 | 95.2 |
mp-27710 | -4.001415 | 1.509338 | 2.831867 | other | Cr1B4 | 5 | 71 | 36.82 |
mp-569529 | -5.618911 | -6.138344 | 0.933027 | other | Ba2Bi3 | 5 | 71 | 198.62 |
mp-784631 | -7.947253 | -0.920196 | 2.998836 | other | Cr1Ni2 | 3 | 71 | 31.8 |
mp-1104100 | -6.711299 | -4.686635 | 6.176454 | other | Nd3Al11 | 14 | 71 | 281.95 |
mp-29266 | -3.582817 | -1.35198 | -5.116884 | original | Cs2S2 | 4 | 71 | 172.99 |
mp-1207654 | -6.199786 | -3.482741 | 4.151315 | other | Zr54Os17 | 71 | 71 | 1,486.56 |
mp-1104161 | -9.18255 | -6.319501 | 4.794202 | other | Dy3Zn11 | 14 | 71 | 242.52 |
mp-2479851 | -7.724598 | -10.862454 | 5.303128 | other | Mg3Cu1 | 4 | 71 | 76.2 |
mp-1178808 | -7.468969 | -1.435993 | 3.729835 | other | V16Ir16 | 32 | 71 | 447.05 |
mp-1104325 | -9.18431 | -6.259223 | 4.773648 | other | Tb3Zn11 | 14 | 71 | 244.44 |
mp-10142 | -4.767854 | 0.220893 | 3.14156 | other | Ta3B4 | 7 | 71 | 72.39 |
mp-12611 | -6.31354 | -6.18234 | 4.254008 | other | Ca3Ga8 | 11 | 71 | 233.95 |
mp-1209415 | -4.032252 | -6.982321 | 1.904769 | other | Rb4C1 | 5 | 71 | 274.62 |
mp-1181754 | -5.30089 | -4.281994 | 0.4587 | other | Cu6As8 | 14 | 71 | 256.17 |
mp-1101830 | -7.139724 | -5.532508 | 4.411717 | other | Yb3Ga8 | 11 | 71 | 234.79 |
mp-29807 | -5.222044 | -2.669815 | 3.090431 | other | Hf27P16 | 43 | 71 | 752.42 |
mp-568048 | -6.401792 | -3.278564 | 4.398346 | other | Hf54Os17 | 71 | 71 | 1,434.8 |
mp-684664 | -5.695772 | -5.452895 | 0.70261 | other | Ga1Sb1 | 2 | 71 | 48.17 |
mp-1103573 | -9.041552 | -6.539536 | 5.016606 | other | Sm3Zn11 | 14 | 71 | 260.76 |
mp-784630 | -7.108811 | -0.674308 | 3.095289 | other | Ni2Mo1 | 3 | 71 | 36.1 |
mp-1389909 | 8.412048 | 2.217344 | -0.870081 | other | Sb1F5 | 6 | 71 | 78.32 |
mp-1096922 | 0.685096 | 3.077852 | 1.552414 | other | Cr18N36 | 54 | 71 | 1,281.18 |
mp-1019239 | 4.750207 | 3.489762 | -3.666555 | other | Pd1N2 | 3 | 71 | 55.8 |
mp-1390563 | 9.49174 | 2.765152 | 0.31905 | other | W1F5 | 6 | 71 | 78.1 |
mp-1096962 | 0.691758 | 3.079053 | 1.546197 | other | Cr32N64 | 96 | 71 | 2,443.39 |
mp-7895 | 7.492756 | 5.650966 | -3.002062 | other | Rb2O2 | 4 | 71 | 88.54 |
mp-1213691 | 5.682191 | 2.20383 | -2.88669 | other | Cs4C60 | 64 | 71 | 852.57 |
mp-1181334 | 6.789818 | 6.314805 | -3.508356 | other | Fe4O13 | 17 | 71 | 195.09 |
mp-1077779 | -4.187685 | -4.138176 | -3.642477 | other | Er2Se4 | 6 | 71 | 144.59 |
mp-1071473 | -6.574886 | -4.392213 | 4.891387 | other | Tb1Ge5 | 6 | 71 | 121.44 |
mp-7896 | 7.302631 | 5.671822 | -2.78487 | other | Cs2O2 | 4 | 71 | 105.42 |
mp-1071531 | 0.584379 | 2.09316 | 2.08456 | other | Re2N4 | 6 | 71 | 68.67 |
mp-574085 | -7.093449 | -5.689002 | 3.600427 | other | Dy5Sn13 | 18 | 71 | 470.5 |
mp-25206 | 6.921239 | 10.656347 | -1.854136 | other | Ni1O2 | 3 | 71 | 43.56 |
mp-1080248 | -4.306315 | -4.753772 | -3.382874 | other | Ce2Se4 | 6 | 72 | 290.56 |
mp-990441 | 9.670016 | 4.392258 | -4.084483 | other | H16O8 | 24 | 72 | 198.85 |
mp-1179443 | -4.447126 | -2.958832 | -3.838431 | other | Si2Se4 | 6 | 72 | 187.37 |
mp-25208 | 7.644853 | 9.180267 | -1.828517 | other | Bi4O8 | 12 | 72 | 214.53 |
mp-30851 | -7.919464 | -3.138164 | 2.803504 | other | Ti6Pt10 | 16 | 72 | 246.56 |
mp-1365 | -5.942293 | -2.705428 | 4.044789 | other | Ti12Ge10 | 22 | 72 | 349.49 |
mp-1014478 | 0.976658 | 2.622471 | 1.620888 | other | Cr2N4 | 6 | 72 | 105.64 |
mp-30139 | -0.183995 | 1.286022 | -4.379084 | other | Be2Br4 | 6 | 72 | 168.55 |
mp-768203 | 3.846451 | -0.614143 | -2.362247 | other | Be6H12 | 18 | 72 | 140.32 |
mp-1011377 | -4.13996 | -4.09516 | -3.305955 | other | Ce2Se4 | 6 | 72 | 159.76 |
mp-568264 | -4.445771 | -2.958762 | -3.840604 | other | Si2Se4 | 6 | 72 | 183.08 |
mp-504746 | -5.72023 | -4.1467 | 0.566259 | other | Cu10As4 | 14 | 72 | 187.78 |
mp-23267 | 1.787669 | 2.368793 | -4.924454 | other | Be2Cl4 | 6 | 72 | 139.54 |
mp-1602 | -3.310222 | -1.781964 | -5.660695 | other | Si2S4 | 6 | 72 | 156.65 |
mp-1770 | -7.187522 | -10.759546 | 5.080068 | other | Mg10Ga4 | 14 | 72 | 281.31 |
mp-672313 | -7.376409 | -6.072877 | 4.255883 | other | Sc12Pb10 | 22 | 72 | 542.66 |
mp-600084 | 15.48191 | 5.701384 | 0.33 | other | Si32O64 | 96 | 72 | 1,733.08 |
mp-1209024 | -7.390224 | -5.533676 | 3.966269 | other | Sc12Sn10 | 22 | 72 | 516.74 |
mp-976 | -6.02387 | -1.106694 | 4.01105 | other | V12Si10 | 22 | 72 | 283.13 |
mp-570886 | -1.034106 | 2.515921 | -3.118954 | other | Be2I4 | 6 | 72 | 221.55 |
mp-22570 | -7.042601 | -9.851696 | 4.666071 | other | Mg10In4 | 14 | 72 | 319.14 |
mp-568313 | -4.043642 | -2.68542 | -3.198922 | other | Si2Se4 | 6 | 72 | 239.97 |
mp-1210614 | -7.463013 | -6.62325 | 5.491547 | other | Lu12Pb10 | 22 | 72 | 595.65 |
mp-696717 | 9.450315 | 4.852375 | -4.130383 | other | H14O8 | 22 | 72 | 171.36 |
mp-570849 | -6.708748 | -10.16676 | 4.41824 | other | Mg10Tl4 | 14 | 72 | 319.78 |
mp-865014 | -8.052564 | -10.329751 | 5.291728 | other | Mg4Cu2 | 6 | 72 | 110.4 |
mp-1071820 | 14.94022 | 5.678796 | -0.074943 | other | Si2O4 | 6 | 72 | 81.96 |
mp-1080275 | -4.045574 | -3.692657 | -3.314544 | other | Ce2Se4 | 6 | 72 | 724.66 |
mp-15659 | -6.792243 | -3.571299 | 0.977741 | other | Sb4Pt6 | 10 | 72 | 192.85 |
mp-1180312 | 17.023109 | 9.503199 | 7.687425 | other | Mg8O8 | 16 | 72 | 183.24 |
mp-1207512 | -8.777765 | -5.79492 | 2.269816 | other | Zn24Au40 | 64 | 72 | 1,006.95 |
mp-7905 | 14.904233 | 5.73881 | -0.122759 | other | Si2O4 | 6 | 72 | 85.17 |
mp-754338 | 8.774681 | 8.952554 | -1.148232 | other | Ag8O4 | 12 | 72 | 197.8 |
mp-1192043 | 16.996445 | 9.513957 | 7.654669 | other | Mg12O12 | 24 | 72 | 270.71 |
mp-632686 | -7.091521 | -0.986029 | 3.724444 | other | Mn10Ge4 | 14 | 72 | 181.83 |
mp-1178476 | 7.227067 | 10.854277 | -1.102334 | other | Cu6O8 | 14 | 72 | 148.65 |
mp-2247 | 5.050166 | 3.359813 | -3.56864 | other | Ag2N6 | 8 | 72 | 115.16 |
mp-25333 | 7.430673 | 8.964129 | -1.511418 | other | Bi4O8 | 12 | 72 | 185.32 |
mp-1182888 | -4.708411 | -4.829173 | 0.205483 | other | Al8As16 | 24 | 73 | 528.27 |
mp-1182873 | -3.334258 | -3.837746 | 0.746648 | other | Al8P16 | 24 | 73 | 433.05 |
mp-1191099 | -4.716169 | -4.804252 | 0.202698 | other | Al8As16 | 24 | 73 | 508.38 |
mp-1191644 | 4.814034 | 0.369424 | -3.232536 | other | H16S8 | 24 | 73 | 364.77 |
mp-1217494 | -4.116957 | -3.568989 | -2.410265 | other | U11Se20 | 31 | 75 | 769.58 |
mp-850083 | -4.880721 | -0.871241 | -4.56631 | other | Fe8S10 | 18 | 75 | 627.49 |
mp-1217564 | -3.151404 | -2.649777 | -3.956555 | other | U11S20 | 31 | 75 | 689.37 |
mp-29783 | 6.202019 | 0.214812 | -3.315382 | other | B40H72 | 112 | 76 | 1,153.59 |
mp-541113 | -3.50664 | -4.069946 | 0.603395 | other | Cs12P28 | 40 | 76 | 1,414.18 |
mp-721582 | 4.783051 | 0.469854 | -3.280118 | other | H32S16 | 48 | 77 | 775.99 |
mp-1338697 | 6.202019 | 0.214812 | -3.315382 | other | B40H72 | 112 | 78 | 1,153.59 |
mp-557933 | 15.584636 | 5.68383 | 0.375676 | other | Si24O48 | 72 | 74 | 1,242.05 |
mp-1071835 | -9.451397 | -4.924735 | 4.524267 | other | Dy2Cu4 | 6 | 74 | 104.4 |
mp-1025122 | -9.421247 | -4.959782 | 4.452276 | other | Lu2Cu4 | 6 | 74 | 99.1 |
mp-22140 | -6.23032 | -4.195449 | 2.89161 | other | Pu2Pd2 | 4 | 74 | 70.14 |
mp-1080762 | -7.313908 | -4.455815 | 5.171242 | other | Np2Ga8 | 10 | 74 | 184.19 |
mp-567258 | -8.639476 | -6.523911 | 4.955247 | original | La2Zn4 | 6 | 74 | 132.72 |
mp-1227358 | -3.492617 | -3.763544 | 0.648497 | other | Be2P4 | 6 | 74 | 97.01 |
mp-1025126 | -2.669762 | -5.294389 | 6.949905 | other | Mg2Si4 | 6 | 74 | 102.03 |
mp-600000 | 15.757743 | 5.598204 | 0.415792 | other | Si8O16 | 24 | 74 | 445.27 |
mp-1100459 | -3.08401 | -5.092638 | 6.747716 | other | Mg2Si4 | 6 | 74 | 96.37 |
mp-1436 | -7.943721 | -6.961147 | 3.021456 | other | Eu2Ag4 | 6 | 74 | 145.93 |
mp-1077442 | -8.792408 | -6.115639 | 2.988628 | other | Ce2Au4 | 6 | 74 | 137.74 |
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